General Information of the Compound
| Compound ID |
CP0338423
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
6-(3-hydroxyphenyl)-3-(5-(piperidin-1-ylmethyl)-1H-indol-2-yl)quinolin-2(1H)-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C29H27N3O2
|
||||||||||||||||||
| Molecular Weight |
449.554
|
||||||||||||||||||
| Canonical SMILES |
Oc1cccc(c1)-c1ccc2[nH]c(=O)c(cc2c1)-c1cc2cc(CN3CCCCC3)ccc2[nH]1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C29H27N3O2/c33-24-6-4-5-20(15-24)21-8-10-27-23(14-21)16-25(29(34)31-27)28-17-22-13-19(7-9-26(22)30-28)18-32-11-2-1-3-12-32/h4-10,13-17,30,33H,1-3,11-12,18H2,(H,31,34)
Show/Hide
|
||||||||||||||||||
| InChIKey |
ZUGRIAPYOYLOBA-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