General Information of the Compound
| Compound ID |
CP0227757
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| Compound Name |
2-phenyl-2-(piperidin-1-yl)-1,1-di(pyridin-3-yl)ethanol
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| Structure |
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| Formula |
C23H25N3O
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| Molecular Weight |
359.473
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| Canonical SMILES |
OC(C(N1CCCCC1)c1ccccc1)(c1cccnc1)c1cccnc1
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| InChI |
InChI=1S/C23H25N3O/c27-23(20-11-7-13-24-17-20,21-12-8-14-25-18-21)22(19-9-3-1-4-10-19)26-15-5-2-6-16-26/h1,3-4,7-14,17-18,22,27H,2,5-6,15-16H2
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| InChIKey |
VFOJZCCGUHQKDE-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