General Information of the Compound
| Compound ID |
CP0290760
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-(4-(1-Isopropylpyrrolidin-3-yl)phenyl)-1H-benzimidazole-4-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C21H24N4O
|
||||||||||||||||||
| Molecular Weight |
348.45
|
||||||||||||||||||
| Canonical SMILES |
CC(C)N1CCC(C1)c1ccc(cc1)-c1nc2c(cccc2[nH]1)C(N)=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C21H24N4O/c1-13(2)25-11-10-16(12-25)14-6-8-15(9-7-14)21-23-18-5-3-4-17(20(22)26)19(18)24-21/h3-9,13,16H,10-12H2,1-2H3,(H2,22,26)(H,23,24)
Show/Hide
|
||||||||||||||||||
| InChIKey |
FHHGATHULHNWHK-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