General Information of the Compound
| Compound ID |
CP0678151
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| Compound Name |
N-(4-chlorophenyl)-3-(2-(2,3-dihydro-1H-tetrazol-5-yl)ethyl)-3-phenylpiperidine-1-carboxamide
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| Structure |
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| Formula |
C21H25ClN6O
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| Molecular Weight |
412.925
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| Canonical SMILES |
O=C(Nc1ccc(Cl)cc1)N1CCCC(CCC2=NNNN2)(c2ccccc2)C1
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| InChI |
InChI=1S/C21H25ClN6O/c22-17-7-9-18(10-8-17)23-20(29)28-14-4-12-21(15-28,16-5-2-1-3-6-16)13-11-19-24-26-27-25-19/h1-3,5-10,26-27H,4,11-15H2,(H,23,29)(H,24,25)
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| InChIKey |
DAHUROVPPIYTLI-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