General Information of the Compound
| Compound ID |
CP0517275
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| Compound Name |
N-methyl-2-[4-(tetrazol-1-yl)phenyl]-N-[1-[[5-(trifluoromethyl)pyridin-2-yl]methyl]piperidin-4-yl]acetamide
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| Structure |
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| Formula |
C22H24F3N7O
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| Molecular Weight |
459.476
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| Canonical SMILES |
CN(C1CCN(Cc2ccc(cn2)C(F)(F)F)CC1)C(=O)Cc1ccc(cc1)-n1cnnn1
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| InChI |
InChI=1S/C22H24F3N7O/c1-30(21(33)12-16-2-6-20(7-3-16)32-15-27-28-29-32)19-8-10-31(11-9-19)14-18-5-4-17(13-26-18)22(23,24)25/h2-7,13,15,19H,8-12,14H2,1H3
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| InChIKey |
RNCKTWHQXIORDB-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