General Information of the Compound
| Compound ID |
CP0506027
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| Compound Name |
N-[2-[3-(2,2-diphenylethyl)piperidin-1-yl]ethyl]-2,4-dimethylpyridine-3-carboxamide
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| Structure |
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| Formula |
C29H35N3O
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| Molecular Weight |
441.619
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| Canonical SMILES |
Cc1ccnc(C)c1C(=O)NCCN1CCCC(CC(c2ccccc2)c2ccccc2)C1
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| InChI |
InChI=1S/C29H35N3O/c1-22-15-16-30-23(2)28(22)29(33)31-17-19-32-18-9-10-24(21-32)20-27(25-11-5-3-6-12-25)26-13-7-4-8-14-26/h3-8,11-16,24,27H,9-10,17-21H2,1-2H3,(H,31,33)
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| InChIKey |
DLNFWGCPPFODIC-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