General Information of the Compound
| Compound ID |
CP0575893
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[2-[(4-chlorophenyl)methylsulfanyl]-3H-benzimidazol-5-yl]-2-(morpholine-4-carbonyl)benzamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H23ClN4O3S
|
||||||||||||||||||
| Molecular Weight |
507.015
|
||||||||||||||||||
| Canonical SMILES |
Clc1ccc(CSc2nc3ccc(NC(=O)c4ccccc4C(=O)N4CCOCC4)cc3[nH]2)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H23ClN4O3S/c27-18-7-5-17(6-8-18)16-35-26-29-22-10-9-19(15-23(22)30-26)28-24(32)20-3-1-2-4-21(20)25(33)31-11-13-34-14-12-31/h1-10,15H,11-14,16H2,(H,28,32)(H,29,30)
Show/Hide
|
||||||||||||||||||
| InChIKey |
RKLMDWSQBIOEFV-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