General Information of the Compound
| Compound ID |
CP0383685
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[(2-methoxyphenyl)methyl]-2-[3-[2-(methylamino)ethylcarbamoyl]phenyl]-5-(trifluoromethyl)pyrazole-3-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H24F3N5O3
|
||||||||||||||||||
| Molecular Weight |
475.471
|
||||||||||||||||||
| Canonical SMILES |
CNCCNC(=O)c1cccc(c1)-n1nc(cc1C(=O)NCc1ccccc1OC)C(F)(F)F
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H24F3N5O3/c1-27-10-11-28-21(32)15-7-5-8-17(12-15)31-18(13-20(30-31)23(24,25)26)22(33)29-14-16-6-3-4-9-19(16)34-2/h3-9,12-13,27H,10-11,14H2,1-2H3,(H,28,32)(H,29,33)
Show/Hide
|
||||||||||||||||||
| InChIKey |
FCZAZZTXGKWUJM-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