General Information of the Compound
| Compound ID |
CP0564482
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[(3S)-1-(cyclobutylamino)-5-(dimethylamino)-1-oxopentan-3-yl]-1-cyclopentyl-5-[2-(trifluoromethyl)phenyl]pyrazole-3-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C27H36F3N5O2
|
||||||||||||||||||
| Molecular Weight |
519.612
|
||||||||||||||||||
| Canonical SMILES |
CN(C)CC[C@@H](CC(=O)NC1CCC1)NC(=O)c1cc(-c2ccccc2C(F)(F)F)n(n1)C1CCCC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C27H36F3N5O2/c1-34(2)15-14-19(16-25(36)31-18-8-7-9-18)32-26(37)23-17-24(35(33-23)20-10-3-4-11-20)21-12-5-6-13-22(21)27(28,29)30/h5-6,12-13,17-20H,3-4,7-11,14-16H2,1-2H3,(H,31,36)(H,32,37)/t19-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
IUAHLCPCSXNWCB-IBGZPJMESA-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 | |||||||||||||||||||
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