General Information of the Compound
| Compound ID |
CP0482640
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(1R,2R)-2-[4-(1H-pyrazol-5-yl)benzoyl]-N-(2-pyridin-2-ylethyl)cyclohexane-1-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H26N4O2
|
||||||||||||||||||
| Molecular Weight |
402.498
|
||||||||||||||||||
| Canonical SMILES |
O=C(NCCc1ccccn1)[C@@H]1CCCC[C@H]1C(=O)c1ccc(cc1)-c1cc[nH]n1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H26N4O2/c29-23(18-10-8-17(9-11-18)22-13-16-27-28-22)20-6-1-2-7-21(20)24(30)26-15-12-19-5-3-4-14-25-19/h3-5,8-11,13-14,16,20-21H,1-2,6-7,12,15H2,(H,26,30)(H,27,28)/t20-,21-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
CJHPFFSSMGEXHF-NHCUHLMSSA-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