General Information of the Compound
| Compound ID |
CP0522687
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| Compound Name |
(2,3-Dimethoxyphenyl)-(1-(p-fluorobenzyl)-piperidine-4-yl)-methanol
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| Structure |
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| Formula |
C21H26FNO3
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| Molecular Weight |
359.441
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| Canonical SMILES |
COc1cccc(C(O)C2CCN(Cc3ccc(F)cc3)CC2)c1OC
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| InChI |
InChI=1S/C21H26FNO3/c1-25-19-5-3-4-18(21(19)26-2)20(24)16-10-12-23(13-11-16)14-15-6-8-17(22)9-7-15/h3-9,16,20,24H,10-14H2,1-2H3
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| InChIKey |
ACARRFRVNJRYJL-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