General Information of the Compound
| Compound ID |
CP0481521
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-[[(Z)-3-oxo-3-(10H-phenothiazin-2-yl)prop-1-enyl]amino]-N-quinoxalin-2-ylbenzenesulfonamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C29H21N5O3S2
|
||||||||||||||||||
| Molecular Weight |
551.653
|
||||||||||||||||||
| Canonical SMILES |
O=C(\C=C/Nc1ccc(cc1)S(=O)(=O)Nc1cnc2ccccc2n1)c1ccc2Sc3ccccc3Nc2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C29H21N5O3S2/c35-26(19-9-14-28-25(17-19)32-24-7-3-4-8-27(24)38-28)15-16-30-20-10-12-21(13-11-20)39(36,37)34-29-18-31-22-5-1-2-6-23(22)33-29/h1-18,30,32H,(H,33,34)/b16-15-
Show/Hide
|
||||||||||||||||||
| InChIKey |
OHKDLGVJSAGTEQ-NXVVXOECSA-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