General Information of the Compound
| Compound ID |
CP0969683
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-(6,7-difluoro-2-phenyl-1H-indol-3-yl)-N-((3S,4R)-4-hydroxy-2-oxopyrrolidin-3-yl)propanamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C21H19F2N3O3
|
||||||||||||||||||
| Molecular Weight |
399.397
|
||||||||||||||||||
| Canonical SMILES |
O=C(CCc1c(-c2ccccc2)[nH]c2c(F)c(F)ccc12)N[C@@H]1C(=O)NC[C@H]1O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C21H19F2N3O3/c22-14-8-6-13-12(7-9-16(28)25-20-15(27)10-24-21(20)29)18(26-19(13)17(14)23)11-4-2-1-3-5-11/h1-6,8,15,20,26-27H,7,9-10H2,(H,24,29)(H,25,28)/t15-,20+/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
HQNWJESWGDGIEY-QRWLVFNGSA-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 | |||||||||||||||||||
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