General Information of the Compound
| Compound ID |
CP0486087
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| Compound Name |
N,2-bis(3-nitrophenyl)quinazolin-4-amine
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| Structure |
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| Formula |
C20H13N5O4
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| Molecular Weight |
387.355
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| Canonical SMILES |
[O-][N+](=O)c1cccc(Nc2nc(nc3ccccc23)-c2cccc(c2)[N+]([O-])=O)c1
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| InChI |
InChI=1S/C20H13N5O4/c26-24(27)15-7-3-5-13(11-15)19-22-18-10-2-1-9-17(18)20(23-19)21-14-6-4-8-16(12-14)25(28)29/h1-12H,(H,21,22,23)
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| InChIKey |
PBNSMPLWHPYOGL-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