General Information of the Compound
| Compound ID |
CP0565330
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-[2-(4-chlorophenyl)-5-(2-cyclobutylacetyl)pyrazol-3-yl]benzenesulfonamide
Show/Hide
|
||||||||||||||||||
| Formula |
C21H20ClN3O3S
|
||||||||||||||||||
| Molecular Weight |
429.929
|
||||||||||||||||||
| Canonical SMILES |
NS(=O)(=O)c1ccc(cc1)-c1cc(nn1-c1ccc(Cl)cc1)C(=O)CC1CCC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C21H20ClN3O3S/c22-16-6-8-17(9-7-16)25-20(15-4-10-18(11-5-15)29(23,27)28)13-19(24-25)21(26)12-14-2-1-3-14/h4-11,13-14H,1-3,12H2,(H2,23,27,28)
Show/Hide
|
||||||||||||||||||
| InChIKey |
OCICGVFLZUPXRH-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 | |||||||||||||||||||
| 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