General Information of the Compound
| Compound ID |
CP0195791
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| Compound Name |
4-N-(3-bromophenyl)-7-chloroquinazoline-4,6-diamine
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| Structure |
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| Formula |
C14H10BrClN4
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| Molecular Weight |
349.619
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| Canonical SMILES |
Nc1cc2c(Nc3cccc(Br)c3)ncnc2cc1Cl
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| InChI |
InChI=1S/C14H10BrClN4/c15-8-2-1-3-9(4-8)20-14-10-5-12(17)11(16)6-13(10)18-7-19-14/h1-7H,17H2,(H,18,19,20)
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| InChIKey |
DXPXPVHLPOANFF-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