General Information of the Compound
| Compound ID |
CP0392626
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| Compound Name |
2-(4-Cyano-phenyl)-N-[1-(3,3-diphenyl-propyl)-piperidin-4-yl]-N-methyl-acetamide
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| Structure |
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| Formula |
C30H33N3O
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| Molecular Weight |
451.614
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| Canonical SMILES |
CN(C1CCN(CCC(c2ccccc2)c2ccccc2)CC1)C(=O)Cc1ccc(cc1)C#N
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| InChI |
InChI=1S/C30H33N3O/c1-32(30(34)22-24-12-14-25(23-31)15-13-24)28-16-19-33(20-17-28)21-18-29(26-8-4-2-5-9-26)27-10-6-3-7-11-27/h2-15,28-29H,16-22H2,1H3
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| InChIKey |
WPJMOEYNICQLQA-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