General Information of the Compound
| Compound ID |
CP0204726
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| Compound Name |
6-Substituted 4-Anilinoquinazoline 33
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| Structure |
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| Formula |
C16H13BrN4O2S
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| Molecular Weight |
405.277
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| Canonical SMILES |
Brc1cccc(Nc2ncnc3ccc(NS(=O)(=O)C=C)cc23)c1
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| InChI |
InChI=1S/C16H13BrN4O2S/c1-2-24(22,23)21-13-6-7-15-14(9-13)16(19-10-18-15)20-12-5-3-4-11(17)8-12/h2-10,21H,1H2,(H,18,19,20)
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| InChIKey |
XDSBIBMMFWAPMJ-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