General Information of the Compound
| Compound ID |
CP0859262
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(3-(1-(2-cyano-4-((1-(4-fluorophenyl)-1H-benzo[d]imidazol-2-yl)methyl)benzyl)piperidin-4-yl)phenyl)acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C35H32FN5O
|
||||||||||||||||||
| Molecular Weight |
557.673
|
||||||||||||||||||
| Canonical SMILES |
CC(=O)Nc1cccc(C2CCN(Cc3ccc(Cc4nc5ccccc5n4-c4ccc(F)cc4)cc3C#N)CC2)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C35H32FN5O/c1-24(42)38-31-6-4-5-27(21-31)26-15-17-40(18-16-26)23-28-10-9-25(19-29(28)22-37)20-35-39-33-7-2-3-8-34(33)41(35)32-13-11-30(36)12-14-32/h2-14,19,21,26H,15-18,20,23H2,1H3,(H,38,42)
Show/Hide
|
||||||||||||||||||
| InChIKey |
ZVZUAXPVZQOROV-UHFFFAOYSA-N
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound