General Information of the Compound
| Compound ID |
CP0522741
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| Compound Name |
N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-5-(4-fluorophenyl)-N-methyltetrazolo[1,5-a]quinoline-4-carboxamide
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| Structure |
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| Formula |
C26H16F7N5O
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| Molecular Weight |
547.434
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| Canonical SMILES |
CN(Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)C(=O)c1c(-c2ccc(F)cc2)c2ccccc2n2nnnc12
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| InChI |
InChI=1S/C26H16F7N5O/c1-37(13-14-10-16(25(28,29)30)12-17(11-14)26(31,32)33)24(39)22-21(15-6-8-18(27)9-7-15)19-4-2-3-5-20(19)38-23(22)34-35-36-38/h2-12H,13H2,1H3
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| InChIKey |
VOHODNOZJSLCHG-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