General Information of the Compound
| Compound ID |
CP0096848
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| Compound Name |
N-(4-chlorophenyl)-3-[2-(dimethylamino)ethyl]-3-phenylpiperidine-1-carboxamide
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| Structure |
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| Formula |
C22H28ClN3O
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| Molecular Weight |
385.939
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| Canonical SMILES |
CN(C)CCC1(CCCN(C1)C(=O)Nc1ccc(Cl)cc1)c1ccccc1
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| InChI |
InChI=1S/C22H28ClN3O/c1-25(2)16-14-22(18-7-4-3-5-8-18)13-6-15-26(17-22)21(27)24-20-11-9-19(23)10-12-20/h3-5,7-12H,6,13-17H2,1-2H3,(H,24,27)
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| InChIKey |
SQMRZYILEJFWLA-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