General Information of the Compound
| Compound ID |
CP0532337
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[(3R)-1-cyclopentylpyrrolidin-3-yl]-N-methyl-4-[(2-methylbenzimidazol-1-yl)methyl]benzamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H32N4O
|
||||||||||||||||||
| Molecular Weight |
416.569
|
||||||||||||||||||
| Canonical SMILES |
CN([C@@H]1CCN(C1)C1CCCC1)C(=O)c1ccc(Cn2c(C)nc3ccccc23)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H32N4O/c1-19-27-24-9-5-6-10-25(24)30(19)17-20-11-13-21(14-12-20)26(31)28(2)23-15-16-29(18-23)22-7-3-4-8-22/h5-6,9-14,22-23H,3-4,7-8,15-18H2,1-2H3/t23-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
OUTIXUKJRJQWBS-HSZRJFAPSA-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