General Property |
Molceule ID (DB) | EGIN0000364 |
Inhibitor Class | Quinazoline |
Molecule Name in Refrence Article | 1d compound |
IUPAC Name | 5-[(4-chlorophenyl)amino]-8-nitroquinazolin-4-ol |
Formula | C14H9ClN4O3 |
Mass | 316.699 |
Exact Mass | 316.0363179 |
Composition | C (53.09%), H (2.86%), Cl (11.19%), N (17.69%), O (15.16%) |
Atom Count | 31 |
PI | 5.51 |
Smiles | c12c(c(ccc1Nc1ccc(cc1)Cl)N(=O)=O)ncnc2O |
InChI | 1S/C14H9ClN4O3/c15-8-1-3-9(4-2-8)18-10-5-6-11(19(21)22)13-12(10)14(20)17-7-16-13/h1-7,18H,(H,16,17,2
0) |
InChIKey | OXLJBWIFBDIMCR-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 | 15993078 |
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 | - |
ChEMBL Link | - |