General Property |
Molceule ID (DB) | EGIN0003210 |
Inhibitor Class | Anilino-quinoline |
Molecule Name in Refrence Article | 11c compound |
IUPAC Name | 8-[(2-chloro-5-methoxyphenyl)amino]-3H-imidazo[4,5-g]quinoline-7-carbonitrile |
Formula | C18H12ClN5O |
Mass | 349.774 |
Exact Mass | 349.0730377 |
Composition | C (61.81%), H (3.46%), Cl (10.14%), N (20.02%), O (4.57%) |
Atom Count | 37 |
PI | 8.65 |
Smiles | c1(c2c(ncc1C#N)cc1c(c2)nc[nH]1)Nc1cc(ccc1Cl)OC |
InChI | 1S/C18H12ClN5O/c1-25-11-2-3-13(19)15(4-11)24-18-10(7-20)8-21-14-6-17-16(5-12(14)18)22-9-23-17/h2-6,8
-9H,1H3,(H,21,24)(H,22,23) |
InChIKey | CSHDSFYZBHILMK-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 | 12217371 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | SRC | |
Pub Chem Link |
5330115
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Drug Bank Link | - |
ChemSpider Link | 4487266 |
ChEMBL Link | CHEMBL92395 |