General Information of the Compound
| Compound ID |
CP0493019
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| Compound Name |
2-N-(3-bromophenyl)-4-N-(furan-2-ylmethyl)quinazoline-2,4-diamine
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| Structure |
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| Formula |
C19H15BrN4O
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| Molecular Weight |
395.26
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| Canonical SMILES |
Brc1cccc(Nc2nc(NCc3ccco3)c3ccccc3n2)c1
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| InChI |
InChI=1S/C19H15BrN4O/c20-13-5-3-6-14(11-13)22-19-23-17-9-2-1-8-16(17)18(24-19)21-12-15-7-4-10-25-15/h1-11H,12H2,(H2,21,22,23,24)
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| InChIKey |
COFMFANODKSCFO-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