General Property |
Molceule ID (DB) | EGIN0001214 |
Inhibitor Class | Anilino-quinazoline |
Molecule Name in Refrence Article | 15 compound |
IUPAC Name | N-[3-(methylsulfanyl)phenyl]quinazolin-4-amine |
Formula | C15H13N3S |
Mass | 267.349 |
Exact Mass | 267.0830181 |
Composition | C (67.39%), H (4.9%), N (15.72%), S (11.99%) |
Atom Count | 32 |
PI | 9.89 |
Smiles | c12c(cccc1)ncnc2Nc1cccc(c1)SC |
InChI | 1S/C15H13N3S/c1-19-12-6-4-5-11(9-12)18-15-13-7-2-3-8-14(13)16-10-17-15/h2-10H,1H3,(H,16,17,18) |
InChIKey | ZLTVUJQOKVLDOP-UHFFFAOYSA-N |
2D Structure | | Structure Backbone | |
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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 | 8825124 |
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 |
31538107
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Drug Bank Link | - |
ChemSpider Link | 25203420 |
ChEMBL Link | - |