General Property |
Molceule ID (DB) | EGIN0004455 |
Inhibitor Class | Anilino-quinazoline |
Molecule Name in Refrence Article | 5o |
IUPAC Name | 8-{[4-(benzyloxy)phenyl]amino}-1-[3-(morpholin-4-yl)propyl]-1H,2H-[1,3]oxazolo[4,5-g]quinazolin-2-one |
Formula | C29H29N5O4 |
Mass | 511.5717 |
Exact Mass | 511.2219544 |
Composition | C (68.09%), H (5.71%), N (13.69%), O (12.51%) |
Atom Count | 67 |
PI | 11.5 |
Smiles | C1OCCN(C1)CCCn1c(=O)oc2c1cc1c(c2)ncnc1Nc1ccc(cc1)OCc1ccccc1 |
InChI | 1S/C29H29N5O4/c35-29-34(12-4-11-33-13-15-36-16-14-33)26-17-24-25(18-27(26)38-29)30-20-31-28(24)32-22
-7-9-23(10-8-22)37-19-21-5-2-1-3-6-21/h1-3,5-10,17-18,20H,4,11-16,19H2,(H,30,31,32) |
InChIKey | RJARHRSDCQNMIU-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 | 22818848 |
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 | 28522143 |
ChEMBL Link | - |