PDB CCD ID: | DTQ |
Number of entries in BioLiP: | 6 |
Chemical formula: | C16 H15 N3 O3 |
InChI: | InChI=1S/C16H15N3O3/c1-21-14-7-12-13(8-15(14)22-2)17-9-18-16(12)19-10-4-3-5-11(20)6-10/h3-9,20H,1-2H3,(H,17,18,19) |
InChIKey: | BNDYIYYKEIXHNK-UHFFFAOYSA-N |
SMILES: | Software | SMILES |
---|
CACTVS 3.341 | COc1cc2ncnc(Nc3cccc(O)c3)c2cc1OC | ACDLabs 10.04 | n2c1c(cc(OC)c(OC)c1)c(nc2)Nc3cccc(O)c3 | OpenEye OEToolkits 1.5.0 | COc1cc2c(cc1OC)ncnc2Nc3cccc(c3)O |
|
Name: | 4-[3-HYDROXYANILINO]-6,7-DIMETHOXYQUINAZOLINE |
ChEMBL: | CHEMBL127907 |
DrugBank: | DB03365 |
ZINC: | ZINC000003828650 |