General Information of the Compound
| Compound ID |
CP0561832
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-[2-(pyrazolo[3,4-c]pyridin-1-ylmethyl)benzimidazol-1-yl]butan-1-ol
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C18H19N5O
|
||||||||||||||||||
| Molecular Weight |
321.384
|
||||||||||||||||||
| Canonical SMILES |
OCCCCn1c(Cn2ncc3ccncc23)nc2ccccc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H19N5O/c24-10-4-3-9-22-16-6-2-1-5-15(16)21-18(22)13-23-17-12-19-8-7-14(17)11-20-23/h1-2,5-8,11-12,24H,3-4,9-10,13H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
UYEQJFQWWCIWTD-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