General Information of the Compound
| Compound ID |
CP0384303
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| Compound Name |
N-[1-[4-(2-methoxyphenyl)piperazin-1-yl]-2-methylpropan-2-yl]-2-(trifluoromethyl)quinazolin-4-amine
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| Structure |
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| Formula |
C24H28F3N5O
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| Molecular Weight |
459.516
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| Canonical SMILES |
COc1ccccc1N1CCN(CC(C)(C)Nc2nc(nc3ccccc23)C(F)(F)F)CC1
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| InChI |
InChI=1S/C24H28F3N5O/c1-23(2,16-31-12-14-32(15-13-31)19-10-6-7-11-20(19)33-3)30-21-17-8-4-5-9-18(17)28-22(29-21)24(25,26)27/h4-11H,12-16H2,1-3H3,(H,28,29,30)
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| InChIKey |
FDSBFCLFSPDFRP-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