Calculated Values
MW: 1,350.02 Hbond donors: 4 Hbond acceptors: 18 cLogP: 9.00 TPSA: 242.40 SMILES: show CN(CCOCCOCCOCCNc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O)CC[C@@H](CSc1ccccc1)Nc1ccc(S(=O)(=O)NC(=O)c2ccc(N3CCN(CC4=C(c5ccc(Cl)cc5)CCC(C)(C)C4)CC3)cc2)cc1S(=O)(=O)C(F)(F)F Linker type: PEG Incubation time (hours): 48 Cells: MOLT-4 DC50: = 2.5 nM Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,305.96 Hbond donors: 4 Hbond acceptors: 17 cLogP: 8.98 TPSA: 233.17 SMILES: show CN(CCOCCOCCNc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O)CC[C@@H](CSc1ccccc1)Nc1ccc(S(=O)(=O)NC(=O)c2ccc(N3CCN(CC4=C(c5ccc(Cl)cc5)CCC(C)(C)C4)CC3)cc2)cc1S(=O)(=O)C(F)(F)F Linker type: PEG Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,405.09 Hbond donors: 4 Hbond acceptors: 19 cLogP: 8.68 TPSA: 245.64 SMILES: show CC1(C)CCC(c2ccc(Cl)cc2)=C(CN2CCN(c3ccc(C(=O)NS(=O)(=O)c4ccc(N[C@@H](CCN5CCN(CCOCCOCCOCCNc6cccc7c6C(=O)N(C6CCC(=O)NC6=O)C7=O)CC5)CSc5ccccc5)c(S(=O)(=O)C(F)(F)F)c4)cc3)CC2)C1 Linker type: PEG Incubation time (hours): 48 Cells: MOLT-4 DC50: = 4.5 nM Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,286.96 Hbond donors: 4 Hbond acceptors: 16 cLogP: 9.02 TPSA: 217.95 SMILES: show CC1(C)CCC(c2ccc(Cl)cc2)=C(CN2CCN(c3ccc(C(=O)NS(=O)(=O)c4ccc(N[C@@H](CCN5CCN(CCCNc6cccc7c6C(=O)N(C6CCC(=O)NC6=O)C7=O)CC5)CSc5ccccc5)c(S(=O)(=O)C(F)(F)F)c4)cc3)CC2)C1 Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,329.00 Hbond donors: 4 Hbond acceptors: 16 cLogP: 9.33 TPSA: 235.02 SMILES: show CC1(C)CCC(c2ccc(Cl)cc2)=C(CN2CCN(c3ccc(C(=O)NS(=O)(=O)c4ccc(N[C@@H](CCN5CCN(C(=O)CCCCNc6cccc7c6C(=O)N(C6CCC(=O)NC6=O)C7=O)CC5)CSc5ccccc5)c(S(=O)(=O)C(F)(F)F)c4)cc3)CC2)C1 Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,361.04 Hbond donors: 4 Hbond acceptors: 18 cLogP: 8.67 TPSA: 236.41 SMILES: show CC1(C)CCC(c2ccc(Cl)cc2)=C(CN2CCN(c3ccc(C(=O)NS(=O)(=O)c4ccc(N[C@@H](CCN5CCN(CCOCCOCCNc6cccc7c6C(=O)N(C6CCC(=O)NC6=O)C7=O)CC5)CSc5ccccc5)c(S(=O)(=O)C(F)(F)F)c4)cc3)CC2)C1 Linker type: PEG Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,245.91 Hbond donors: 4 Hbond acceptors: 15 cLogP: 9.73 TPSA: 214.71 SMILES: show CN(CCCCNc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O)CC[C@@H](CSc1ccccc1)Nc1ccc(S(=O)(=O)NC(=O)c2ccc(N3CCN(CC4=C(c5ccc(Cl)cc5)CCC(C)(C)C4)CC3)cc2)cc1S(=O)(=O)C(F)(F)F Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,515.21 Hbond donors: 4 Hbond acceptors: 21 cLogP: 10.26 TPSA: 290.18 SMILES: show CN(CC[C@@H](CSc1ccccc1)Nc1ccc(S(=O)(=O)NC(=O)c2ccc(N3CCN(CC4=C(c5ccc(Cl)cc5)CCC(C)(C)C4)CC3)cc2)cc1S(=O)(=O)C(F)(F)F)C(=O)CCCCCCn1cc(COCCOCCOCCNc2cccc3c2C(=O)N(C2CCC(=O)NC2=O)C3=O)nn1 Linker type: Other Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,314.97 Hbond donors: 4 Hbond acceptors: 16 cLogP: 8.94 TPSA: 235.02 SMILES: show CC1(C)CCC(c2ccc(Cl)cc2)=C(CN2CCN(c3ccc(C(=O)NS(=O)(=O)c4ccc(N[C@@H](CCN5CCN(C(=O)CCCNc6cccc7c6C(=O)N(C6CCC(=O)NC6=O)C7=O)CC5)CSc5ccccc5)c(S(=O)(=O)C(F)(F)F)c4)cc3)CC2)C1 Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,419.08 Hbond donors: 4 Hbond acceptors: 19 cLogP: 8.21 TPSA: 262.71 SMILES: show CC1(C)CCC(c2ccc(Cl)cc2)=C(CN2CCN(c3ccc(C(=O)NS(=O)(=O)c4ccc(N[C@@H](CCN5CCN(C(=O)COCCOCCOCCNc6cccc7c6C(=O)N(C6CCC(=O)NC6=O)C7=O)CC5)CSc5ccccc5)c(S(=O)(=O)C(F)(F)F)c4)cc3)CC2)C1 Linker type: PEG Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,343.03 Hbond donors: 4 Hbond acceptors: 16 cLogP: 9.72 TPSA: 235.02 SMILES: show CC1(C)CCC(c2ccc(Cl)cc2)=C(CN2CCN(c3ccc(C(=O)NS(=O)(=O)c4ccc(N[C@@H](CCN5CCN(C(=O)CCCCCNc6cccc7c6C(=O)N(C6CCC(=O)NC6=O)C7=O)CC5)CSc5ccccc5)c(S(=O)(=O)C(F)(F)F)c4)cc3)CC2)C1 Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,316.99 Hbond donors: 4 Hbond acceptors: 17 cLogP: 8.65 TPSA: 227.18 SMILES: show CC1(C)CCC(c2ccc(Cl)cc2)=C(CN2CCN(c3ccc(C(=O)NS(=O)(=O)c4ccc(N[C@@H](CCN5CCN(CCOCCNc6cccc7c6C(=O)N(C6CCC(=O)NC6=O)C7=O)CC5)CSc5ccccc5)c(S(=O)(=O)C(F)(F)F)c4)cc3)CC2)C1 Linker type: PEG Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,463.13 Hbond donors: 4 Hbond acceptors: 20 cLogP: 8.22 TPSA: 271.94 SMILES: show CC1(C)CCC(c2ccc(Cl)cc2)=C(CN2CCN(c3ccc(C(=O)NS(=O)(=O)c4ccc(N[C@@H](CCN5CCN(C(=O)COCCOCCOCCOCCNc6cccc7c6C(=O)N(C6CCC(=O)NC6=O)C7=O)CC5)CSc5ccccc5)c(S(=O)(=O)C(F)(F)F)c4)cc3)CC2)C1 Linker type: PEG Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,231.88 Hbond donors: 4 Hbond acceptors: 15 cLogP: 9.34 TPSA: 214.71 SMILES: show CN(CCCNc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O)CC[C@@H](CSc1ccccc1)Nc1ccc(S(=O)(=O)NC(=O)c2ccc(N3CCN(CC4=C(c5ccc(Cl)cc5)CCC(C)(C)C4)CC3)cc2)cc1S(=O)(=O)C(F)(F)F Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 DC50: = 10.6 nM Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,375.02 Hbond donors: 4 Hbond acceptors: 18 cLogP: 8.19 TPSA: 253.48 SMILES: show CC1(C)CCC(c2ccc(Cl)cc2)=C(CN2CCN(c3ccc(C(=O)NS(=O)(=O)c4ccc(N[C@@H](CCN5CCN(C(=O)COCCOCCNc6cccc7c6C(=O)N(C6CCC(=O)NC6=O)C7=O)CC5)CSc5ccccc5)c(S(=O)(=O)C(F)(F)F)c4)cc3)CC2)C1 Linker type: PEG Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,429.08 Hbond donors: 4 Hbond acceptors: 20 cLogP: 9.08 TPSA: 280.95 SMILES: show CN(CC[C@@H](CSc1ccccc1)Nc1ccc(S(=O)(=O)NC(=O)c2ccc(N3CCN(CC4=C(c5ccc(Cl)cc5)CCC(C)(C)C4)CC3)cc2)cc1S(=O)(=O)C(F)(F)F)C(=O)CCCn1cc(COCCOCCNc2cccc3c2C(=O)N(C2CCC(=O)NC2=O)C3=O)nn1 Linker type: Other Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,457.17 Hbond donors: 4 Hbond acceptors: 20 cLogP: 10.72 TPSA: 263.88 SMILES: show CN(CCCCCCCn1cc(COCCOCCNc2cccc3c2C(=O)N(C2CCC(=O)NC2=O)C3=O)nn1)CC[C@@H](CSc1ccccc1)Nc1ccc(S(=O)(=O)NC(=O)c2ccc(N3CCN(CC4=C(c5ccc(Cl)cc5)CCC(C)(C)C4)CC3)cc2)cc1S(=O)(=O)C(F)(F)F Linker type: Other Incubation time (hours): 48 Cells: MOLT-4 DC50: = 6.3 nM Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,394.07 Hbond donors: 4 Hbond acceptors: 19 cLogP: 9.01 TPSA: 251.63 SMILES: show CN(CCOCCOCCOCCOCCNc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O)CC[C@@H](CSc1ccccc1)Nc1ccc(S(=O)(=O)NC(=O)c2ccc(N3CCN(CC4=C(c5ccc(Cl)cc5)CCC(C)(C)C4)CC3)cc2)cc1S(=O)(=O)C(F)(F)F Linker type: PEG Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,471.16 Hbond donors: 4 Hbond acceptors: 20 cLogP: 10.25 TPSA: 280.95 SMILES: show CN(CC[C@@H](CSc1ccccc1)Nc1ccc(S(=O)(=O)NC(=O)c2ccc(N3CCN(CC4=C(c5ccc(Cl)cc5)CCC(C)(C)C4)CC3)cc2)cc1S(=O)(=O)C(F)(F)F)C(=O)CCCCCCn1cc(COCCOCCNc2cccc3c2C(=O)N(C2CCC(=O)NC2=O)C3=O)nn1 Linker type: Other Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,300.99 Hbond donors: 4 Hbond acceptors: 16 cLogP: 9.41 TPSA: 217.95 SMILES: show CC1(C)CCC(c2ccc(Cl)cc2)=C(CN2CCN(c3ccc(C(=O)NS(=O)(=O)c4ccc(N[C@@H](CCN5CCN(CCCCNc6cccc7c6C(=O)N(C6CCC(=O)NC6=O)C7=O)CC5)CSc5ccccc5)c(S(=O)(=O)C(F)(F)F)c4)cc3)CC2)C1 Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,259.94 Hbond donors: 4 Hbond acceptors: 15 cLogP: 10.12 TPSA: 214.71 SMILES: show CN(CCCCCNc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O)CC[C@@H](CSc1ccccc1)Nc1ccc(S(=O)(=O)NC(=O)c2ccc(N3CCN(CC4=C(c5ccc(Cl)cc5)CCC(C)(C)C4)CC3)cc2)cc1S(=O)(=O)C(F)(F)F Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,501.23 Hbond donors: 4 Hbond acceptors: 21 cLogP: 10.74 TPSA: 273.11 SMILES: show CN(CCCCCCCn1cc(COCCOCCOCCNc2cccc3c2C(=O)N(C2CCC(=O)NC2=O)C3=O)nn1)CC[C@@H](CSc1ccccc1)Nc1ccc(S(=O)(=O)NC(=O)c2ccc(N3CCN(CC4=C(c5ccc(Cl)cc5)CCC(C)(C)C4)CC3)cc2)cc1S(=O)(=O)C(F)(F)F Linker type: Other Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,315.02 Hbond donors: 4 Hbond acceptors: 16 cLogP: 9.80 TPSA: 217.95 SMILES: show CC1(C)CCC(c2ccc(Cl)cc2)=C(CN2CCN(c3ccc(C(=O)NS(=O)(=O)c4ccc(N[C@@H](CCN5CCN(CCCCCNc6cccc7c6C(=O)N(C6CCC(=O)NC6=O)C7=O)CC5)CSc5ccccc5)c(S(=O)(=O)C(F)(F)F)c4)cc3)CC2)C1 Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,404.07 Hbond donors: 5 Hbond acceptors: 18 cLogP: 8.37 TPSA: 265.51 SMILES: show CC1(C)CCC(c2ccc(Cl)cc2)=C(CN2CCN(c3ccc(C(=O)NS(=O)(=O)c4ccc(N[C@@H](CCN5CCN(C(=O)NCCOCCOCCNc6cccc7c6C(=O)N(C6CCC(=O)NC6=O)C7=O)CC5)CSc5ccccc5)c(S(=O)(=O)C(F)(F)F)c4)cc3)CC2)C1 Linker type: PEG Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,473.13 Hbond donors: 4 Hbond acceptors: 21 cLogP: 9.09 TPSA: 290.18 SMILES: show CN(CC[C@@H](CSc1ccccc1)Nc1ccc(S(=O)(=O)NC(=O)c2ccc(N3CCN(CC4=C(c5ccc(Cl)cc5)CCC(C)(C)C4)CC3)cc2)cc1S(=O)(=O)C(F)(F)F)C(=O)CCCn1cc(COCCOCCOCCNc2cccc3c2C(=O)N(C2CCC(=O)NC2=O)C3=O)nn1 Linker type: Other Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,273.96 Hbond donors: 4 Hbond acceptors: 15 cLogP: 10.51 TPSA: 214.71 SMILES: show CN(CCCCCCNc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O)CC[C@@H](CSc1ccccc1)Nc1ccc(S(=O)(=O)NC(=O)c2ccc(N3CCN(CC4=C(c5ccc(Cl)cc5)CCC(C)(C)C4)CC3)cc2)cc1S(=O)(=O)C(F)(F)F Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,371.08 Hbond donors: 4 Hbond acceptors: 16 cLogP: 10.50 TPSA: 235.02 SMILES: show CC1(C)CCC(c2ccc(Cl)cc2)=C(CN2CCN(c3ccc(C(=O)NS(=O)(=O)c4ccc(N[C@@H](CCN5CCN(C(=O)CCCCCCCNc6cccc7c6C(=O)N(C6CCC(=O)NC6=O)C7=O)CC5)CSc5ccccc5)c(S(=O)(=O)C(F)(F)F)c4)cc3)CC2)C1 Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,302.02 Hbond donors: 4 Hbond acceptors: 15 cLogP: 11.29 TPSA: 214.71 SMILES: show CN(CCCCCCCCNc1cccc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O)CC[C@@H](CSc1ccccc1)Nc1ccc(S(=O)(=O)NC(=O)c2ccc(N3CCN(CC4=C(c5ccc(Cl)cc5)CCC(C)(C)C4)CC3)cc2)cc1S(=O)(=O)C(F)(F)F Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,420.13 Hbond donors: 5 Hbond acceptors: 18 cLogP: 8.54 TPSA: 248.44 SMILES: show CC1(C)CCC(c2ccc(Cl)cc2)=C(CN2CCN(c3ccc(C(=O)NS(=O)(=O)c4ccc(N[C@@H](CCN5CCN(C(=S)NCCOCCOCCNc6cccc7c6C(=O)N(C6CCC(=O)NC6=O)C7=O)CC5)CSc5ccccc5)c(S(=O)(=O)C(F)(F)F)c4)cc3)CC2)C1 Linker type: PEG Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,357.05 Hbond donors: 4 Hbond acceptors: 16 cLogP: 10.11 TPSA: 235.02 SMILES: show CC1(C)CCC(c2ccc(Cl)cc2)=C(CN2CCN(c3ccc(C(=O)NS(=O)(=O)c4ccc(N[C@@H](CCN5CCN(C(=O)CCCCCCNc6cccc7c6C(=O)N(C6CCC(=O)NC6=O)C7=O)CC5)CSc5ccccc5)c(S(=O)(=O)C(F)(F)F)c4)cc3)CC2)C1 Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon |
Calculated Values
MW: 1,544.36 Hbond donors: 5 Hbond acceptors: 18 cLogP: 11.24 TPSA: 260.30 SMILES: show Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCOCCC(=O)N2CCN(CC[C@H](CSc3ccccc3)Nc3ccc(S(=O)(=O)NC(=O)c4ccc(N5CCN(CC6=C(c7ccc(Cl)cc7)CCC(C)(C)C6)CC5)cc4)cc3S(=O)(=O)C(F)(F)F)CC2)C(C)(C)C)cc1 Linker type: PEG Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,542.39 Hbond donors: 5 Hbond acceptors: 17 cLogP: 12.40 TPSA: 251.07 SMILES: show Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCCCC(=O)N2CCN(CC[C@H](CSc3ccccc3)Nc3ccc(S(=O)(=O)NC(=O)c4ccc(N5CCN(CC6=C(c7ccc(Cl)cc7)CCC(C)(C)C6)CC5)cc4)cc3S(=O)(=O)C(F)(F)F)CC2)C(C)(C)C)cc1 Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 DC50: = 53 nM Dmax: ~ 100 % Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,579.40 Hbond donors: 5 Hbond acceptors: 20 cLogP: 11.30 TPSA: 267.68 SMILES: show Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)COCCOCCOCCOCCN(C)CC[C@H](CSc2ccccc2)Nc2ccc(S(=O)(=O)NC(=O)c3ccc(N4CCN(CC5=C(c6ccc(Cl)cc6)CCC(C)(C)C5)CC4)cc3)cc2S(=O)(=O)C(F)(F)F)C(C)(C)C)cc1 Linker type: PEG Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,542.43 Hbond donors: 5 Hbond acceptors: 17 cLogP: 13.26 TPSA: 234.00 SMILES: show Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCCCCCN2CCN(CC[C@H](CSc3ccccc3)Nc3ccc(S(=O)(=O)NC(=O)c4ccc(N5CCN(CC6=C(c7ccc(Cl)cc7)CCC(C)(C)C6)CC5)cc4)cc3S(=O)(=O)C(F)(F)F)CC2)C(C)(C)C)cc1 Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,487.35 Hbond donors: 5 Hbond acceptors: 16 cLogP: 13.58 TPSA: 230.76 SMILES: show Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCCCCCN(C)CC[C@H](CSc2ccccc2)Nc2ccc(S(=O)(=O)NC(=O)c3ccc(N4CCN(CC5=C(c6ccc(Cl)cc6)CCC(C)(C)C5)CC4)cc3)cc2S(=O)(=O)C(F)(F)F)C(C)(C)C)cc1 Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,546.38 Hbond donors: 5 Hbond acceptors: 19 cLogP: 10.95 TPSA: 252.46 SMILES: show Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)COCCOCCN2CCN(CC[C@H](CSc3ccccc3)Nc3ccc(S(=O)(=O)NC(=O)c4ccc(N5CCN(CC6=C(c7ccc(Cl)cc7)CCC(C)(C)C6)CC5)cc4)cc3S(=O)(=O)C(F)(F)F)CC2)C(C)(C)C)cc1 Linker type: PEG Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,473.33 Hbond donors: 5 Hbond acceptors: 16 cLogP: 13.19 TPSA: 230.76 SMILES: show Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCCCCN(C)CC[C@H](CSc2ccccc2)Nc2ccc(S(=O)(=O)NC(=O)c3ccc(N4CCN(CC5=C(c6ccc(Cl)cc6)CCC(C)(C)C5)CC4)cc3)cc2S(=O)(=O)C(F)(F)F)C(C)(C)C)cc1 Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 DC50: = 71 nM Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,501.38 Hbond donors: 5 Hbond acceptors: 16 cLogP: 13.97 TPSA: 230.76 SMILES: show Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCCCCCCN(C)CC[C@H](CSc2ccccc2)Nc2ccc(S(=O)(=O)NC(=O)c3ccc(N4CCN(CC5=C(c6ccc(Cl)cc6)CCC(C)(C)C5)CC4)cc3)cc2S(=O)(=O)C(F)(F)F)C(C)(C)C)cc1 Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,560.36 Hbond donors: 5 Hbond acceptors: 19 cLogP: 10.48 TPSA: 269.53 SMILES: show Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)COCCOCC(=O)N2CCN(CC[C@H](CSc3ccccc3)Nc3ccc(S(=O)(=O)NC(=O)c4ccc(N5CCN(CC6=C(c7ccc(Cl)cc7)CCC(C)(C)C6)CC5)cc4)cc3S(=O)(=O)C(F)(F)F)CC2)C(C)(C)C)cc1 Linker type: PEG Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,459.30 Hbond donors: 5 Hbond acceptors: 16 cLogP: 12.80 TPSA: 230.76 SMILES: show Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCCCN(C)CC[C@H](CSc2ccccc2)Nc2ccc(S(=O)(=O)NC(=O)c3ccc(N4CCN(CC5=C(c6ccc(Cl)cc6)CCC(C)(C)C5)CC4)cc3)cc2S(=O)(=O)C(F)(F)F)C(C)(C)C)cc1 Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,491.30 Hbond donors: 5 Hbond acceptors: 18 cLogP: 11.27 TPSA: 249.22 SMILES: show Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)COCCOCCN(C)CC[C@H](CSc2ccccc2)Nc2ccc(S(=O)(=O)NC(=O)c3ccc(N4CCN(CC5=C(c6ccc(Cl)cc6)CCC(C)(C)C5)CC4)cc3)cc2S(=O)(=O)C(F)(F)F)C(C)(C)C)cc1 Linker type: PEG Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,556.42 Hbond donors: 5 Hbond acceptors: 17 cLogP: 12.79 TPSA: 251.07 SMILES: show Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCCCCC(=O)N2CCN(CC[C@H](CSc3ccccc3)Nc3ccc(S(=O)(=O)NC(=O)c4ccc(N5CCN(CC6=C(c7ccc(Cl)cc7)CCC(C)(C)C6)CC5)cc4)cc3S(=O)(=O)C(F)(F)F)CC2)C(C)(C)C)cc1 Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,500.35 Hbond donors: 5 Hbond acceptors: 17 cLogP: 12.09 TPSA: 234.00 SMILES: show Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCCN2CCN(CC[C@H](CSc3ccccc3)Nc3ccc(S(=O)(=O)NC(=O)c4ccc(N5CCN(CC6=C(c7ccc(Cl)cc7)CCC(C)(C)C6)CC5)cc4)cc3S(=O)(=O)C(F)(F)F)CC2)C(C)(C)C)cc1 Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,502.32 Hbond donors: 5 Hbond acceptors: 18 cLogP: 10.94 TPSA: 243.23 SMILES: show Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)COCCN2CCN(CC[C@H](CSc3ccccc3)Nc3ccc(S(=O)(=O)NC(=O)c4ccc(N5CCN(CC6=C(c7ccc(Cl)cc7)CCC(C)(C)C6)CC5)cc4)cc3S(=O)(=O)C(F)(F)F)CC2)C(C)(C)C)cc1 Linker type: PEG Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,528.41 Hbond donors: 5 Hbond acceptors: 17 cLogP: 12.87 TPSA: 234.00 SMILES: show Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCCCCN2CCN(CC[C@H](CSc3ccccc3)Nc3ccc(S(=O)(=O)NC(=O)c4ccc(N5CCN(CC6=C(c7ccc(Cl)cc7)CCC(C)(C)C6)CC5)cc4)cc3S(=O)(=O)C(F)(F)F)CC2)C(C)(C)C)cc1 Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,445.27 Hbond donors: 5 Hbond acceptors: 16 cLogP: 12.41 TPSA: 230.76 SMILES: show Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCCN(C)CC[C@H](CSc2ccccc2)Nc2ccc(S(=O)(=O)NC(=O)c3ccc(N4CCN(CC5=C(c6ccc(Cl)cc6)CCC(C)(C)C5)CC4)cc3)cc2S(=O)(=O)C(F)(F)F)C(C)(C)C)cc1 Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,514.38 Hbond donors: 5 Hbond acceptors: 17 cLogP: 12.48 TPSA: 234.00 SMILES: show Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCCCN2CCN(CC[C@H](CSc3ccccc3)Nc3ccc(S(=O)(=O)NC(=O)c4ccc(N5CCN(CC6=C(c7ccc(Cl)cc7)CCC(C)(C)C6)CC5)cc4)cc3S(=O)(=O)C(F)(F)F)CC2)C(C)(C)C)cc1 Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 DC50: = 93 nM Dmax: ~ 90 % Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,535.35 Hbond donors: 5 Hbond acceptors: 19 cLogP: 11.28 TPSA: 258.45 SMILES: show Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)COCCOCCOCCN(C)CC[C@H](CSc2ccccc2)Nc2ccc(S(=O)(=O)NC(=O)c3ccc(N4CCN(CC5=C(c6ccc(Cl)cc6)CCC(C)(C)C5)CC4)cc3)cc2S(=O)(=O)C(F)(F)F)C(C)(C)C)cc1 Linker type: PEG Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,515.41 Hbond donors: 5 Hbond acceptors: 16 cLogP: 14.36 TPSA: 230.76 SMILES: show Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCCCCCCCN(C)CC[C@H](CSc2ccccc2)Nc2ccc(S(=O)(=O)NC(=O)c3ccc(N4CCN(CC5=C(c6ccc(Cl)cc6)CCC(C)(C)C5)CC4)cc3)cc2S(=O)(=O)C(F)(F)F)C(C)(C)C)cc1 Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,528.36 Hbond donors: 5 Hbond acceptors: 17 cLogP: 12.01 TPSA: 251.07 SMILES: show Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCCC(=O)N2CCN(CC[C@H](CSc3ccccc3)Nc3ccc(S(=O)(=O)NC(=O)c4ccc(N5CCN(CC6=C(c7ccc(Cl)cc7)CCC(C)(C)C6)CC5)cc4)cc3S(=O)(=O)C(F)(F)F)CC2)C(C)(C)C)cc1 Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,574.39 Hbond donors: 5 Hbond acceptors: 19 cLogP: 10.87 TPSA: 269.53 SMILES: show Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)COCCCOCC(=O)N2CCN(CC[C@H](CSc3ccccc3)Nc3ccc(S(=O)(=O)NC(=O)c4ccc(N5CCN(CC6=C(c7ccc(Cl)cc7)CCC(C)(C)C6)CC5)cc4)cc3S(=O)(=O)C(F)(F)F)CC2)C(C)(C)C)cc1 Linker type: PEG Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,500.31 Hbond donors: 5 Hbond acceptors: 17 cLogP: 11.23 TPSA: 251.07 SMILES: show Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCC(=O)N2CCN(CC[C@H](CSc3ccccc3)Nc3ccc(S(=O)(=O)NC(=O)c4ccc(N5CCN(CC6=C(c7ccc(Cl)cc7)CCC(C)(C)C6)CC5)cc4)cc3S(=O)(=O)C(F)(F)F)CC2)C(C)(C)C)cc1 Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,486.28 Hbond donors: 5 Hbond acceptors: 17 cLogP: 10.84 TPSA: 251.07 SMILES: show Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CC(=O)N2CCN(CC[C@H](CSc3ccccc3)Nc3ccc(S(=O)(=O)NC(=O)c4ccc(N5CCN(CC6=C(c7ccc(Cl)cc7)CCC(C)(C)C6)CC5)cc4)cc3S(=O)(=O)C(F)(F)F)CC2)C(C)(C)C)cc1 Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,487.31 Hbond donors: 5 Hbond acceptors: 16 cLogP: 12.71 TPSA: 247.83 SMILES: show Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCCCC(=O)N(C)CC[C@H](CSc2ccccc2)Nc2ccc(S(=O)(=O)NC(=O)c3ccc(N4CCN(CC5=C(c6ccc(Cl)cc6)CCC(C)(C)C5)CC4)cc3)cc2S(=O)(=O)C(F)(F)F)C(C)(C)C)cc1 Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon
Calculated Values
MW: 1,514.34 Hbond donors: 5 Hbond acceptors: 17 cLogP: 11.62 TPSA: 251.07 SMILES: show Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCC(=O)N2CCN(CC[C@H](CSc3ccccc3)Nc3ccc(S(=O)(=O)NC(=O)c4ccc(N5CCN(CC6=C(c7ccc(Cl)cc7)CCC(C)(C)C6)CC5)cc4)cc3S(=O)(=O)C(F)(F)F)CC2)C(C)(C)C)cc1 Linker type: Alkane Incubation time (hours): 48 Cells: MOLT-4 Off-targets reported?: No degradation of BCL2 Comments: IC50's are for cell viability assays Contributed by: Ronen Gabizon |