General Information of the Compound
| Compound ID |
CP0921705
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(3,5-bis(trifluoromethyl)phenyl)-1-(2,6-dimethylphenyl)-3-(methylamino)-5-oxopyrrolidine-3-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H21F6N3O2
|
||||||||||||||||||
| Molecular Weight |
473.417
|
||||||||||||||||||
| Canonical SMILES |
CNC1(C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC(=O)N(c2c(C)cccc2C)C1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H21F6N3O2/c1-12-5-4-6-13(2)18(12)31-11-20(29-3,10-17(31)32)19(33)30-16-8-14(21(23,24)25)7-15(9-16)22(26,27)28/h4-9,29H,10-11H2,1-3H3,(H,30,33)
Show/Hide
|
||||||||||||||||||
| InChIKey |
GHHVKXZDCNGTPN-UHFFFAOYSA-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