General Information of the Compound
Compound ID |
CP0168034
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Compound Name |
4-[(7-hydroxy-6-methoxyquinazolin-4-yl)amino]-N-phenylbenzamide
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Structure |
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Formula |
C22H18N4O3
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Molecular Weight |
386.411
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Canonical SMILES |
COc1cc2c(Nc3ccc(cc3)C(=O)Nc3ccccc3)ncnc2cc1O
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InChI |
InChI=1S/C22H18N4O3/c1-29-20-11-17-18(12-19(20)27)23-13-24-21(17)25-16-9-7-14(8-10-16)22(28)26-15-5-3-2-4-6-15/h2-13,27H,1H3,(H,26,28)(H,23,24,25)
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InChIKey |
YQTIZDYSQKQTBQ-UHFFFAOYSA-N
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Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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ChEMBL ID |