General Information of the Compound
| Compound ID |
CP0529161
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| Compound Name |
N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N-methyl-5-phenylpyrrolo[1,2-a]quinoline-4-carboxamide
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| Structure |
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| Formula |
C29H20F6N2O
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| Molecular Weight |
526.48
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| Canonical SMILES |
CN(Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)C(=O)c1c(-c2ccccc2)c2ccccc2n2cccc12
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| InChI |
InChI=1S/C29H20F6N2O/c1-36(17-18-14-20(28(30,31)32)16-21(15-18)29(33,34)35)27(38)26-24-12-7-13-37(24)23-11-6-5-10-22(23)25(26)19-8-3-2-4-9-19/h2-16H,17H2,1H3
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| InChIKey |
FQHVTKMBKJGDDK-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