General Information of the Compound
| Compound ID |
CP0431264
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| Compound Name |
N-cyclopropyl-N-[1-(3,3-diphenylpropyl)piperidin-4-yl]-2-(4-methylsulfonylphenyl)acetamide
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| Structure |
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| Formula |
C32H38N2O3S
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| Molecular Weight |
530.734
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| Canonical SMILES |
CS(=O)(=O)c1ccc(CC(=O)N(C2CC2)C2CCN(CCC(c3ccccc3)c3ccccc3)CC2)cc1
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| InChI |
InChI=1S/C32H38N2O3S/c1-38(36,37)30-16-12-25(13-17-30)24-32(35)34(28-14-15-28)29-18-21-33(22-19-29)23-20-31(26-8-4-2-5-9-26)27-10-6-3-7-11-27/h2-13,16-17,28-29,31H,14-15,18-24H2,1H3
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| InChIKey |
YQBDDKXLWVVVHC-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