General Information of the Compound
| Compound ID |
CP0961512
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| Compound Name |
N-(3,4-dichlorophenyl)-6-(methyloxy)-7-{[(4-prop-2-en-1-ylmorpholin-2-yl)methyl]oxy}quinazolin-4-amine
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| Structure |
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| Formula |
C23H24Cl2N4O3
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| Molecular Weight |
475.376
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| Canonical SMILES |
C=CCN1CCOC(COc2cc3ncnc(Nc4ccc(Cl)c(Cl)c4)c3cc2OC)C1
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| InChI |
InChI=1S/C23H24Cl2N4O3/c1-3-6-29-7-8-31-16(12-29)13-32-22-11-20-17(10-21(22)30-2)23(27-14-26-20)28-15-4-5-18(24)19(25)9-15/h3-5,9-11,14,16H,1,6-8,12-13H2,2H3,(H,26,27,28)
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| InChIKey |
HZQVPHRLYRINCU-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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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound