General Information of the Compound
| Compound ID |
CP0636295
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2'-Chloro-5-(isobutyryl-methyl-amino)-4'-methyl-biphenyl-3-carboxylic acid((S)-2-hydroxy-1-methyl-ethyl)-amide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H27ClN2O3
|
||||||||||||||||||
| Molecular Weight |
402.922
|
||||||||||||||||||
| Canonical SMILES |
Cc1ccc(-c2cc(C(=O)N[C@@H](C)CO)cc(N(C)C(=O)C(C)C)c2)c(Cl)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H27ClN2O3/c1-13(2)22(28)25(5)18-10-16(19-7-6-14(3)8-20(19)23)9-17(11-18)21(27)24-15(4)12-26/h6-11,13,15,26H,12H2,1-5H3,(H,24,27)/t15-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
HDBDJYCFDQATKH-HNNXBMFYSA-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