General Information of the Compound
| Compound ID |
CP0364246
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| Compound Name |
4-N-(3-bromophenyl)-7-N,7-N-dimethylquinazoline-4,6,7-triamine
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| Structure |
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| Formula |
C16H16BrN5
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| Molecular Weight |
358.243
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| Canonical SMILES |
CN(C)c1cc2ncnc(Nc3cccc(Br)c3)c2cc1N
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| InChI |
InChI=1S/C16H16BrN5/c1-22(2)15-8-14-12(7-13(15)18)16(20-9-19-14)21-11-5-3-4-10(17)6-11/h3-9H,18H2,1-2H3,(H,19,20,21)
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| InChIKey |
LVYWXEWYKYOVOX-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