General Information of the Compound
| Compound ID |
CP0550169
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(3S)-N-[(4-chlorophenyl)-[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-5-oxopyrrolidine-3-carboxamide
Show/Hide
|
||||||||||||||||||
| Formula |
C19H15ClF4N2O2
|
||||||||||||||||||
| Molecular Weight |
414.786
|
||||||||||||||||||
| Canonical SMILES |
Fc1ccc(cc1C(F)(F)F)C(NC(=O)[C@@H]1CNC(=O)C1)c1ccc(Cl)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H15ClF4N2O2/c20-13-4-1-10(2-5-13)17(26-18(28)12-8-16(27)25-9-12)11-3-6-15(21)14(7-11)19(22,23)24/h1-7,12,17H,8-9H2,(H,25,27)(H,26,28)/t12-,17?/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
JEBZXAPYAMBRPR-WHUIICBVSA-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 | |||||||||||||||||||
| 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