General Information of the Compound
| Compound ID |
CP0400708
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(2S)-N-[4-(2-chlorophenoxy)phenyl]-2-[[2-(1H-imidazol-5-yl)acetyl]amino]-3-phenylmethoxypropanamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C27H25ClN4O4
|
||||||||||||||||||
| Molecular Weight |
504.974
|
||||||||||||||||||
| Canonical SMILES |
Clc1ccccc1Oc1ccc(NC(=O)[C@H](COCc2ccccc2)NC(=O)Cc2cnc[nH]2)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C27H25ClN4O4/c28-23-8-4-5-9-25(23)36-22-12-10-20(11-13-22)31-27(34)24(17-35-16-19-6-2-1-3-7-19)32-26(33)14-21-15-29-18-30-21/h1-13,15,18,24H,14,16-17H2,(H,29,30)(H,31,34)(H,32,33)/t24-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
SOUAEJKSAIJWNB-DEOSSOPVSA-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