General Information of the Compound
| Compound ID |
CP0456338
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| Compound Name |
1-(4-(methylsulfonyl)phenyl)-1'-(5-(trifluoromethyl)pyridin-2-yl)-4,4'-bipiperidine
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| Structure |
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| Formula |
C23H28F3N3O2S
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| Molecular Weight |
467.557
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| Canonical SMILES |
CS(=O)(=O)c1ccc(cc1)N1CCC(CC1)C1CCN(CC1)c1ccc(cn1)C(F)(F)F
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| InChI |
InChI=1S/C23H28F3N3O2S/c1-32(30,31)21-5-3-20(4-6-21)28-12-8-17(9-13-28)18-10-14-29(15-11-18)22-7-2-19(16-27-22)23(24,25)26/h2-7,16-18H,8-15H2,1H3
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| InChIKey |
UUMPPUAHNVJXCJ-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
Protein ID: PT02398, Glucose-dependent insulinotropic receptor
Protein ID: PT02455, Glucose-dependent insulinotropic receptor