General Information of the Compound
| Compound ID |
CP0538002
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-chloro-2-methyl-N-[6-(4-methylphenyl)-7-oxo-4,5-dihydro-1H-pyrazolo[3,4-c]pyridin-3-yl]benzenesulfonamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H19ClN4O3S
|
||||||||||||||||||
| Molecular Weight |
430.917
|
||||||||||||||||||
| Canonical SMILES |
Cc1ccc(cc1)N1CCc2c(NS(=O)(=O)c3cccc(Cl)c3C)n[nH]c2C1=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H19ClN4O3S/c1-12-6-8-14(9-7-12)25-11-10-15-18(20(25)26)22-23-19(15)24-29(27,28)17-5-3-4-16(21)13(17)2/h3-9H,10-11H2,1-2H3,(H2,22,23,24)
Show/Hide
|
||||||||||||||||||
| InChIKey |
AGWOFOKQPOYZQT-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