General Information of the Compound
| Compound ID |
CP0534541
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1'-[[1-(4-hydroxybutyl)-5-methylbenzimidazol-2-yl]methyl]spiro[cyclopropane-1,3'-indole]-2'-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H25N3O2
|
||||||||||||||||||
| Molecular Weight |
375.472
|
||||||||||||||||||
| Canonical SMILES |
Cc1ccc2n(CCCCO)c(CN3C(=O)C4(CC4)c4ccccc34)nc2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H25N3O2/c1-16-8-9-20-18(14-16)24-21(25(20)12-4-5-13-27)15-26-19-7-3-2-6-17(19)23(10-11-23)22(26)28/h2-3,6-9,14,27H,4-5,10-13,15H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
WOIOCDOEVKYZIW-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