General Information of the Compound
| Compound ID |
CP0469577
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| Compound Name |
4-Anilinoquinazoline deriv. 42
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| Structure |
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| Formula |
C14H11BrN4
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| Molecular Weight |
315.174
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| Canonical SMILES |
Nc1cccc2ncnc(Nc3cccc(Br)c3)c12
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| InChI |
InChI=1S/C14H11BrN4/c15-9-3-1-4-10(7-9)19-14-13-11(16)5-2-6-12(13)17-8-18-14/h1-8H,16H2,(H,17,18,19)
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| InChIKey |
VFDHVXMKHJATKX-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