General Information of the Compound
| Compound ID |
CP0547259
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| Compound Name |
4-N-phenyl-2-[3-(trifluoromethyl)phenyl]quinazoline-4,6-diamine
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| Structure |
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| Formula |
C21H15F3N4
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| Molecular Weight |
380.373
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| Canonical SMILES |
Nc1ccc2nc(nc(Nc3ccccc3)c2c1)-c1cccc(c1)C(F)(F)F
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| InChI |
InChI=1S/C21H15F3N4/c22-21(23,24)14-6-4-5-13(11-14)19-27-18-10-9-15(25)12-17(18)20(28-19)26-16-7-2-1-3-8-16/h1-12H,25H2,(H,26,27,28)
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| InChIKey |
YOMYMWYMNDUUOR-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