General Information of the Compound
| Compound ID |
CP0539437
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| Compound Name |
N-propan-2-yl-2-(trifluoromethyl)quinazolin-4-amine
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| Structure |
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| Formula |
C12H12F3N3
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| Molecular Weight |
255.243
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| Canonical SMILES |
CC(C)Nc1nc(nc2ccccc12)C(F)(F)F
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| InChI |
InChI=1S/C12H12F3N3/c1-7(2)16-10-8-5-3-4-6-9(8)17-11(18-10)12(13,14)15/h3-7H,1-2H3,(H,16,17,18)
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| InChIKey |
ZHVSFCUYYDUDGJ-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