General Information of the Compound
| Compound ID |
CP0487125
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-Amino-N-(4-benzyl-5-methyl-isoxazol-3-yl)-benzenesulfonamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C17H17N3O3S
|
||||||||||||||||||
| Molecular Weight |
343.408
|
||||||||||||||||||
| Canonical SMILES |
Cc1onc(NS(=O)(=O)c2ccc(N)cc2)c1Cc1ccccc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C17H17N3O3S/c1-12-16(11-13-5-3-2-4-6-13)17(19-23-12)20-24(21,22)15-9-7-14(18)8-10-15/h2-10H,11,18H2,1H3,(H,19,20)
Show/Hide
|
||||||||||||||||||
| InChIKey |
XMOANPKYGGTYSQ-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