General Information of the Compound
| Compound ID |
CP0851320
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(3S,4S)-N-(3-chloro-5-(trifluoromethyl)phenyl)-1-(2,6-dimethylphenyl)-3-ethyl-4-methyl-5-oxopyrrolidine-3-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H24ClF3N2O2
|
||||||||||||||||||
| Molecular Weight |
452.904
|
||||||||||||||||||
| Canonical SMILES |
CC[C@@]1(C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)CN(c2c(C)cccc2C)C(=O)[C@H]1C
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H24ClF3N2O2/c1-5-22(21(31)28-18-10-16(23(25,26)27)9-17(24)11-18)12-29(20(30)15(22)4)19-13(2)7-6-8-14(19)3/h6-11,15H,5,12H2,1-4H3,(H,28,31)/t15-,22-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
ITTHHSANLHMJGT-IVZQSRNASA-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