General Information of the Compound
| Compound ID |
CP0406837
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[4-[5-amino-1-(3-methylphenyl)pyrazol-3-yl]phenyl]-4-methoxybenzenesulfonamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H22N4O3S
|
||||||||||||||||||
| Molecular Weight |
434.521
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1cc(N)n(n1)-c1cccc(C)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H22N4O3S/c1-16-4-3-5-19(14-16)27-23(24)15-22(25-27)17-6-8-18(9-7-17)26-31(28,29)21-12-10-20(30-2)11-13-21/h3-15,26H,24H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
GDQBWTIZBKXGCR-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