General Information of the Compound
| Compound ID |
CP0244285
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[1-oxo-6-(1,3-thiazol-2-ylsulfanyl)-2,3-dihydroinden-5-yl]methanesulfonamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C13H12N2O3S3
|
||||||||||||||||||
| Molecular Weight |
340.451
|
||||||||||||||||||
| Canonical SMILES |
CS(=O)(=O)Nc1cc2CCC(=O)c2cc1Sc1nccs1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C13H12N2O3S3/c1-21(17,18)15-10-6-8-2-3-11(16)9(8)7-12(10)20-13-14-4-5-19-13/h4-7,15H,2-3H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
DXXOQPYKXLLPNU-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