General Information of the Compound
| Compound ID |
CP0472950
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-(3,3-dimethylbutyl)-N-[[5-(2-methylpropyl)-1-phenylpyrazol-3-yl]methyl]-3-azabicyclo[3.1.0]hexane-6-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H38N4O
|
||||||||||||||||||
| Molecular Weight |
422.617
|
||||||||||||||||||
| Canonical SMILES |
CC(C)Cc1cc(CNC(=O)C2C3CN(CCC(C)(C)C)CC23)nn1-c1ccccc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H38N4O/c1-18(2)13-21-14-19(28-30(21)20-9-7-6-8-10-20)15-27-25(31)24-22-16-29(17-23(22)24)12-11-26(3,4)5/h6-10,14,18,22-24H,11-13,15-17H2,1-5H3,(H,27,31)
Show/Hide
|
||||||||||||||||||
| InChIKey |
DOKOGLOPIXTMOO-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