General Information of the Compound
| Compound ID |
CP0372736
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-[7-fluoro-3,3-dimethyl-2-oxo-1-(2-phenylethyl)indol-5-yl]-1-methylpyrrole-2-carbonitrile
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H22FN3O
|
||||||||||||||||||
| Molecular Weight |
387.458
|
||||||||||||||||||
| Canonical SMILES |
Cn1c(ccc1-c1cc2c(N(CCc3ccccc3)C(=O)C2(C)C)c(F)c1)C#N
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H22FN3O/c1-24(2)19-13-17(21-10-9-18(15-26)27(21)3)14-20(25)22(19)28(23(24)29)12-11-16-7-5-4-6-8-16/h4-10,13-14H,11-12H2,1-3H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
GVPWNKABXKSXGY-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