General Property |
Molceule ID (DB) | EGIN0000167 |
Inhibitor Class | Quinazoline |
Molecule Name in Refrence Article | 6 compound |
IUPAC Name | 6-chloro-2-(4-methylphenyl)-3,4-dihydroquinazoline-4-thione |
Formula | C15H11ClN2S |
Mass | 286.779 |
Exact Mass | 286.0331468 |
Composition | C (62.82%), H (3.87%), Cl (12.36%), N (9.77%), S (11.18%) |
Atom Count | 30 |
PI | 4.58 |
Smiles | [nH]1c(=S)c2c(nc1c1ccc(cc1)C)ccc(c2)Cl |
InChI | 1S/C15H11ClN2S/c1-9-2-4-10(5-3-9)14-17-13-7-6-11(16)8-12(13)15(19)18-14/h2-8H,1H3,(H,17,18,19) |
InChIKey | JREOBWJMPMKWQP-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0000167.png) | Structure Backbone | ![](./frame/f_EGIN0000167.png) |
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View Structure in Jmol | Click to view 3 d structure Download Mol File |
Drug Like Property | Druglikeliness |
Symmetry & Geometry | Symmetry And Geometrical Information |
Activity & Binding | Activity against isoform and covalant binding information |
Topological Properties | Descriptors |
Reference | 20599299 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | No activity data against other kinases present in database |
Pub Chem Link |
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Drug Bank Link | - |
ChemSpider Link | 26349842 |
ChEMBL Link | CHEMBL1241309 |