General Information of the Compound
| Compound ID |
CP0682595
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
SID24794939
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C15H11NO2S
|
||||||||||||||||||
| Molecular Weight |
269.325
|
||||||||||||||||||
| Canonical SMILES |
CN1C(=O)/C(=C\C(=O)c2cccs2)c2ccccc21
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C15H11NO2S/c1-16-12-6-3-2-5-10(12)11(15(16)18)9-13(17)14-7-4-8-19-14/h2-9H,1H3/b11-9-
Show/Hide
|
||||||||||||||||||
| InChIKey |
FXRHSOJHHUQOEY-LUAWRHEFSA-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
Protein ID: PT06109, Geminin
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT06124, Paired box protein Pax-8