General Information of the Compound
| Compound ID |
CP0415016
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| Compound Name |
8-[(3-Bromophenyl)amino]-1-methyl-1H-imidazo[4,5-g]-quinazoline
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| Structure |
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| Formula |
C16H12BrN5
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| Molecular Weight |
354.211
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| Canonical SMILES |
Cn1cnc2cc3ncnc(Nc4cccc(Br)c4)c3cc12
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| InChI |
InChI=1S/C16H12BrN5/c1-22-9-20-14-7-13-12(6-15(14)22)16(19-8-18-13)21-11-4-2-3-10(17)5-11/h2-9H,1H3,(H,18,19,21)
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| InChIKey |
LQIKOEJHMCCOSP-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