Calculated Values
MW: 915.53 Hbond donors: 3 Hbond acceptors: 9 cLogP: 7.36 TPSA: 178.10 SMILES: show Cc1cc([C@H](C(=O)N2C[C@@H](O)C[C@@H]2C(=O)N[C@@H](CC(=O)N2CCC(C#Cc3ccc(C(=O)N[C@H]4C(C)(C)[C@H](Oc5ccc(C#N)c(Cl)c5)C4(C)C)cc3)CC2)c2ccccc2)C(C)C)on1 Linker type: Other Incubation time (hours): 0.5,1,3,6,12,24 Cells: LNCaP DC50: = 0.5352 nM Dmax: > 99 % Off-targets reported?: No Contributed by: Adi Rogel
Calculated Values
MW: 946.59 Hbond donors: 3 Hbond acceptors: 10 cLogP: 7.16 TPSA: 181.34 SMILES: show Cc1cc([C@H](C(=O)N2C[C@@H](O)C[C@@H]2C(=O)N[C@@H](CC(=O)N2CCC(N3CC(c4ccc(C(=O)N[C@H]5C(C)(C)[C@H](Oc6ccc(C#N)c(Cl)c6)C5(C)C)cc4)C3)CC2)c2ccccc2)C(C)C)on1 Linker type: Other Incubation time (hours): 6 Cells: LNCaP Dmax: > 99 % Off-targets reported?: No Contributed by: Adi Rogel
Calculated Values
MW: 946.59 Hbond donors: 3 Hbond acceptors: 10 cLogP: 7.44 TPSA: 181.34 SMILES: show Cc1cc([C@H](C(=O)N2C[C@@H](O)C[C@@H]2C(=O)N[C@@H](CC(=O)N2CCC(C3CN(c4ccc(C(=O)N[C@H]5C(C)(C)[C@H](Oc6ccc(C#N)c(Cl)c6)C5(C)C)cc4)C3)CC2)c2ccccc2)C(C)C)on1 Linker type: Other Incubation time (hours): 6 Cells: LNCaP Dmax: > 99 % Off-targets reported?: No Contributed by: Adi Rogel
Calculated Values
MW: 891.51 Hbond donors: 3 Hbond acceptors: 9 cLogP: 7.48 TPSA: 178.10 SMILES: show Cc1cc([C@H](C(=O)N2C[C@@H](O)C[C@@H]2C(=O)N[C@@H](CC(=O)N2CCC(c3ccc(C(=O)N[C@H]4C(C)(C)[C@H](Oc5ccc(C#N)c(Cl)c5)C4(C)C)cc3)CC2)c2ccccc2)C(C)C)on1 Linker type: Other Incubation time (hours): 6 Cells: LNCaP Dmax: > 99 % Off-targets reported?: No Contributed by: Adi Rogel
Calculated Values
MW: 970.61 Hbond donors: 3 Hbond acceptors: 10 cLogP: 7.04 TPSA: 181.34 SMILES: show Cc1cc([C@H](C(=O)N2C[C@@H](O)C[C@@H]2C(=O)N[C@@H](CC(=O)N2CCC(N3CC(C#Cc4ccc(C(=O)N[C@H]5C(C)(C)[C@H](Oc6ccc(C#N)c(Cl)c6)C5(C)C)cc4)C3)CC2)c2ccccc2)C(C)C)on1 Linker type: Other Incubation time (hours): 6 Cells: LNCaP Dmax: = 86 % Off-targets reported?: No Contributed by: Adi Rogel
Calculated Values
MW: 892.50 Hbond donors: 3 Hbond acceptors: 10 cLogP: 6.42 TPSA: 181.34 SMILES: show Cc1cc([C@H](C(=O)N2C[C@@H](O)C[C@@H]2C(=O)N[C@@H](CC(=O)N2CCN(c3ccc(C(=O)N[C@H]4C(C)(C)[C@H](Oc5ccc(C#N)c(Cl)c5)C4(C)C)cc3)CC2)c2ccccc2)C(C)C)on1 Linker type: Other Incubation time (hours): 6 Cells: LNCaP Dmax: > 99 % Off-targets reported?: No Contributed by: Adi Rogel
Calculated Values
MW: 998.67 Hbond donors: 3 Hbond acceptors: 10 cLogP: 7.82 TPSA: 181.34 SMILES: show Cc1cc([C@H](C(=O)N2C[C@@H](O)C[C@@H]2C(=O)N[C@@H](CC(=O)N2CCC(N3CCC(C#Cc4ccc(C(=O)N[C@H]5C(C)(C)[C@H](Oc6ccc(C#N)c(Cl)c6)C5(C)C)cc4)CC3)CC2)c2ccccc2)C(C)C)on1 Linker type: Other Incubation time (hours): 6 Cells: LNCaP Dmax: > 99 % Off-targets reported?: No Contributed by: Adi Rogel
Calculated Values
MW: 970.61 Hbond donors: 3 Hbond acceptors: 10 cLogP: 7.04 TPSA: 181.34 SMILES: show Cc1cc([C@H](C(=O)N2C[C@@H](O)C[C@@H]2C(=O)N[C@@H](CC(=O)N2CC(N3CCC(C#Cc4ccc(C(=O)N[C@H]5C(C)(C)[C@H](Oc6ccc(C#N)c(Cl)c6)C5(C)C)cc4)CC3)C2)c2ccccc2)C(C)C)on1 Linker type: Other Incubation time (hours): 6 Cells: LNCaP Dmax: = 68 % Off-targets reported?: No Contributed by: Adi Rogel |
Calculated Values
MW: 940.54 Hbond donors: 3 Hbond acceptors: 10 cLogP: 7.23 TPSA: 201.89 SMILES: show Cc1cc([C@H](C(=O)N2C[C@@H](O)C[C@@H]2C(=O)N[C@@H](CC(=O)N2CCC(C#Cc3ccc(C(=O)N[C@H]4C(C)(C)[C@H](Oc5ccc(C#N)c(Cl)c5)C4(C)C)cc3)CC2)c2ccc(C#N)cc2)C(C)C)on1 Linker type: Other Incubation time (hours): 6 Cells: LNCaP Dmax: > 99 % Off-targets reported?: No Contributed by: Adi Rogel
Calculated Values
MW: 1,023.68 Hbond donors: 3 Hbond acceptors: 11 cLogP: 7.70 TPSA: 205.13 SMILES: show Cc1cc([C@H](C(=O)N2C[C@@H](O)C[C@@H]2C(=O)N[C@@H](CC(=O)N2CCC(N3CCC(C#Cc4ccc(C(=O)N[C@H]5C(C)(C)[C@H](Oc6ccc(C#N)c(Cl)c6)C5(C)C)cc4)CC3)CC2)c2ccc(C#N)cc2)C(C)C)on1 Linker type: Other Incubation time (hours): 6 Cells: LNCaP Dmax: > 99 % Off-targets reported?: No Contributed by: Adi Rogel |
Calculated Values
MW: 1,095.81 Hbond donors: 3 Hbond acceptors: 12 cLogP: 9.26 TPSA: 194.23 SMILES: show Cc1cc([C@H](C(=O)N2C[C@@H](O)C[C@@H]2C(=O)N[C@@H](CC(=O)N2CCC(N3CCC(C#Cc4ccc(C(=O)N[C@H]5C(C)(C)[C@H](Oc6ccc(C#N)c(Cl)c6)C5(C)C)cc4)CC3)CC2)c2ccc(-c3scnc3C)cc2)C(C)C)on1 Linker type: Other Incubation time (hours): 0.5,1,3,6,12,24 Cells: LNCaP DC50: = 7.2 nM Dmax: > 99 % Off-targets reported?: No Contributed by: Adi Rogel
Calculated Values
MW: 1,012.67 Hbond donors: 3 Hbond acceptors: 11 cLogP: 8.79 TPSA: 190.99 SMILES: show Cc1cc([C@H](C(=O)N2C[C@@H](O)C[C@@H]2C(=O)N[C@@H](CC(=O)N2CCC(C#Cc3ccc(C(=O)N[C@H]4C(C)(C)[C@H](Oc5ccc(C#N)c(Cl)c5)C4(C)C)cc3)CC2)c2ccc(-c3scnc3C)cc2)C(C)C)on1 Linker type: Other Incubation time (hours): 6 Cells: LNCaP Dmax: > 99 % Off-targets reported?: No Contributed by: Adi Rogel |
Calculated Values
MW: 1,033.11 Hbond donors: 3 Hbond acceptors: 10 cLogP: 8.48 TPSA: 181.34 SMILES: show Cc1cc([C@H](C(=O)N2C[C@@H](O)C[C@@H]2C(=O)N[C@@H](CC(=O)N2CCC(N3CCC(C#Cc4ccc(C(=O)N[C@H]5C(C)(C)[C@H](Oc6ccc(C#N)c(Cl)c6)C5(C)C)cc4)CC3)CC2)c2ccc(Cl)cc2)C(C)C)on1 Linker type: Other Incubation time (hours): 6 Cells: LNCaP Dmax: > 99 % Off-targets reported?: No Contributed by: Adi Rogel
Calculated Values
MW: 949.98 Hbond donors: 3 Hbond acceptors: 9 cLogP: 8.01 TPSA: 178.10 SMILES: show Cc1cc([C@H](C(=O)N2C[C@@H](O)C[C@@H]2C(=O)N[C@@H](CC(=O)N2CCC(C#Cc3ccc(C(=O)N[C@H]4C(C)(C)[C@H](Oc5ccc(C#N)c(Cl)c5)C4(C)C)cc3)CC2)c2ccc(Cl)cc2)C(C)C)on1 Linker type: Other Incubation time (hours): 6 Cells: LNCaP Dmax: > 99 % Off-targets reported?: No Contributed by: Adi Rogel |
Calculated Values
MW: 1,022.69 Hbond donors: 3 Hbond acceptors: 10 cLogP: 7.81 TPSA: 181.34 SMILES: show C#Cc1ccc([C@H](CC(=O)N2CCC(N3CCC(C#Cc4ccc(C(=O)N[C@H]5C(C)(C)[C@H](Oc6ccc(C#N)c(Cl)c6)C5(C)C)cc4)CC3)CC2)NC(=O)[C@H]2C[C@H](O)CN2C(=O)[C@@H](c2cc(C)no2)C(C)C)cc1 Linker type: Other Incubation time (hours): 6 Cells: LNCaP Dmax: > 99 % Off-targets reported?: No Contributed by: Adi Rogel
Calculated Values
MW: 939.55 Hbond donors: 3 Hbond acceptors: 9 cLogP: 7.34 TPSA: 178.10 SMILES: show C#Cc1ccc([C@H](CC(=O)N2CCC(C#Cc3ccc(C(=O)N[C@H]4C(C)(C)[C@H](Oc5ccc(C#N)c(Cl)c5)C4(C)C)cc3)CC2)NC(=O)[C@H]2C[C@H](O)CN2C(=O)[C@@H](c2cc(C)no2)C(C)C)cc1 Linker type: Other Incubation time (hours): 6 Cells: LNCaP Dmax: > 99 % Off-targets reported?: No Contributed by: Adi Rogel |
Calculated Values
MW: 994.43 Hbond donors: 3 Hbond acceptors: 9 cLogP: 8.12 TPSA: 178.10 SMILES: show Cc1cc([C@H](C(=O)N2C[C@@H](O)C[C@@H]2C(=O)N[C@@H](CC(=O)N2CCC(C#Cc3ccc(C(=O)N[C@H]4C(C)(C)[C@H](Oc5ccc(C#N)c(Cl)c5)C4(C)C)cc3)CC2)c2ccc(Br)cc2)C(C)C)on1 Linker type: Other Incubation time (hours): 6 Cells: LNCaP Dmax: > 99 % Off-targets reported?: No Contributed by: Adi Rogel
Calculated Values
MW: 1,077.56 Hbond donors: 3 Hbond acceptors: 10 cLogP: 8.59 TPSA: 181.34 SMILES: show Cc1cc([C@H](C(=O)N2C[C@@H](O)C[C@@H]2C(=O)N[C@@H](CC(=O)N2CCC(N3CCC(C#Cc4ccc(C(=O)N[C@H]5C(C)(C)[C@H](Oc6ccc(C#N)c(Cl)c6)C5(C)C)cc4)CC3)CC2)c2ccc(Br)cc2)C(C)C)on1 Linker type: Other Incubation time (hours): 6 Cells: LNCaP Dmax: > 95 % Off-targets reported?: No Contributed by: Adi Rogel |
Calculated Values
MW: 933.52 Hbond donors: 3 Hbond acceptors: 9 cLogP: 7.50 TPSA: 178.10 SMILES: show Cc1cc([C@H](C(=O)N2C[C@@H](O)C[C@@H]2C(=O)N[C@@H](CC(=O)N2CCC(C#Cc3ccc(C(=O)N[C@H]4C(C)(C)[C@H](Oc5ccc(C#N)c(Cl)c5)C4(C)C)cc3)CC2)c2ccc(F)cc2)C(C)C)on1 Linker type: Other Incubation time (hours): 6 Cells: LNCaP Dmax: > 99 % Off-targets reported?: No Contributed by: Adi Rogel
Calculated Values
MW: 1,016.66 Hbond donors: 3 Hbond acceptors: 10 cLogP: 7.96 TPSA: 181.34 SMILES: show Cc1cc([C@H](C(=O)N2C[C@@H](O)C[C@@H]2C(=O)N[C@@H](CC(=O)N2CCC(N3CCC(C#Cc4ccc(C(=O)N[C@H]5C(C)(C)[C@H](Oc6ccc(C#N)c(Cl)c6)C5(C)C)cc4)CC3)CC2)c2ccc(F)cc2)C(C)C)on1 Linker type: Other Incubation time (hours): 6 Cells: LNCaP Dmax: > 99 % Off-targets reported?: No Contributed by: Adi Rogel |
Calculated Values
MW: 891.51 Hbond donors: 4 Hbond acceptors: 8 cLogP: 5.78 TPSA: 181.17 SMILES: show CC(=O)N[C@H](C(=O)N1C[C@@H](O)C[C@@H]1C(=O)N[C@@H](CC(=O)N1CCC(C#Cc2ccc(C(=O)N[C@H]3C(C)(C)[C@H](Oc4ccc(C#N)c(Cl)c4)C3(C)C)cc2)CC1)c1ccccc1)C(C)C Linker type: Other Incubation time (hours): 6 Cells: LNCaP Dmax: < 5 % Off-targets reported?: No Contributed by: Adi Rogel
Calculated Values
MW: 988.67 Hbond donors: 4 Hbond acceptors: 9 cLogP: 6.50 TPSA: 184.41 SMILES: show CC(=O)NC[C@H](C(=O)N1C[C@@H](O)C[C@@H]1C(=O)N[C@@H](CC(=O)N1CCC(N2CCC(C#Cc3ccc(C(=O)N[C@H]4C(C)(C)[C@H](Oc5ccc(C#N)c(Cl)c5)C4(C)C)cc3)CC2)CC1)c1ccccc1)C(C)C Linker type: Other Incubation time (hours): 6 Cells: LNCaP Dmax: = 11 % Off-targets reported?: No Contributed by: Adi Rogel |