General Information of the Compound
| Compound ID |
CP0384702
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| Compound Name |
1-[(4-chloro-2-fluorophenyl)methyl]-4-pyrrolidin-1-ylpiperidine
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| Structure |
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| Formula |
C16H22ClFN2
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| Molecular Weight |
296.817
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| Canonical SMILES |
Fc1cc(Cl)ccc1CN1CCC(CC1)N1CCCC1
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| InChI |
InChI=1S/C16H22ClFN2/c17-14-4-3-13(16(18)11-14)12-19-9-5-15(6-10-19)20-7-1-2-8-20/h3-4,11,15H,1-2,5-10,12H2
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| InChIKey |
HAFIWCOXOQIRQQ-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