General Property |
Molceule ID (DB) | EGIN0002333 |
Inhibitor Class | Pyrimidine |
Molecule Name in Refrence Article | 3 compound |
IUPAC Name | 2-imino-5-[(1Z)-2-(2-methoxyphenyl)-3-methylbut-1-en-1-yl]-2H,3H-furo[2,3-d]pyrimidin-4-amine |
Formula | C18H20N4O2 |
Mass | 324.377 |
Exact Mass | 324.1586259 |
Composition | C (66.65%), H (6.21%), N (17.27%), O (9.86%) |
Atom Count | 44 |
PI | 12.74 |
Smiles | CC(C)/C(=C/c1coc2c1c(N)[nH]c(=N)n2)/c1ccccc1OC |
InChI | 1S/C18H20N4O2/c1-10(2)13(12-6-4-5-7-14(12)23-3)8-11-9-24-17-15(11)16(19)21-18(20)22-17/h4-10H,1-3H3,
(H4,19,20,21,22)/b13-8- |
InChIKey | ZBHMLBFDTQKTKI-JYRVWZFOSA-N |
2D Structure | ![](./image/EGIN0002333.png) | Structure Backbone | ![](./frame/f_EGIN0002333.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 | 19748785 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | VEGFR2 | PDGFR beta | DHFR human | ALL |
Pub Chem Link |
44246320
|
Drug Bank Link | - |
ChemSpider Link | 24649173 |
ChEMBL Link | CHEMBL594810 |