General Information of the Compound
| Compound ID |
CP0479924
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[(2-methoxyphenyl)methyl]-2-[3-[1-[2-(methylamino)ethylamino]ethyl]phenyl]-5-(trifluoromethyl)pyrazole-3-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H28F3N5O2
|
||||||||||||||||||
| Molecular Weight |
475.515
|
||||||||||||||||||
| Canonical SMILES |
CNCCNC(C)c1cccc(c1)-n1nc(cc1C(=O)NCc1ccccc1OC)C(F)(F)F
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H28F3N5O2/c1-16(29-12-11-28-2)17-8-6-9-19(13-17)32-20(14-22(31-32)24(25,26)27)23(33)30-15-18-7-4-5-10-21(18)34-3/h4-10,13-14,16,28-29H,11-12,15H2,1-3H3,(H,30,33)
Show/Hide
|
||||||||||||||||||
| InChIKey |
XEIFZBWMFYSKNU-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