General Property |
Molceule ID (DB) | EGIN0003977 |
Inhibitor Class | Quinazoline |
Molecule Name in Refrence Article | 14 compound |
IUPAC Name | 4-(6,7-dimethoxyquinazolin-4-yl)-N-[4-(propan-2-yl)phenyl]piperazine-1-carboxamide |
Formula | C24H29N5O3 |
Mass | 435.5188 |
Exact Mass | 435.2270398 |
Composition | C (66.19%), H (6.71%), N (16.08%), O (11.02%) |
Atom Count | 61 |
PI | 9.5 |
Smiles | c12c(N3CCN(C(=O)Nc4ccc(cc4)C(C)C)CC3)ncnc1cc(c(c2)OC)OC |
InChI | 1S/C24H29N5O3/c1-16(2)17-5-7-18(8-6-17)27-24(30)29-11-9-28(10-12-29)23-19-13-21(31-3)22(32-4)14-20(1
9)25-15-26-23/h5-8,13-16H,9-12H2,1-4H3,(H,27,30) |
InChIKey | CDPYJPHBGSGNJS-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0003977.png) | Structure Backbone | ![](./frame/f_EGIN0003977.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 | 12086491 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | FGFR | PKA | PKC | Src | beta PDGFR | c-Kit | Flt3 | alpha-PDGFR | ALL |
Pub Chem Link |
11048367
|
Drug Bank Link | - |
ChemSpider Link | 9223534 |
ChEMBL Link | CHEMBL104067 |