General Information of the Compound
| Compound ID |
CP0967697
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(3S,4S)-1-(2,6-dimethylphenyl)-3-isopropyl-N-(3-(isopropylamino)-5-(trifluoromethyl)phenyl)-4-methyl-5-oxopyrrolidine-3-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C27H34F3N3O2
|
||||||||||||||||||
| Molecular Weight |
489.582
|
||||||||||||||||||
| Canonical SMILES |
Cc1cccc(C)c1N1C[C@](C(=O)Nc2cc(NC(C)C)cc(C(F)(F)F)c2)(C(C)C)[C@H](C)C1=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C27H34F3N3O2/c1-15(2)26(14-33(24(34)19(26)7)23-17(5)9-8-10-18(23)6)25(35)32-22-12-20(27(28,29)30)11-21(13-22)31-16(3)4/h8-13,15-16,19,31H,14H2,1-7H3,(H,32,35)/t19-,26+/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
FHKVCGWXWJWLHU-BCHFMIIMSA-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