General Information of the Compound
| Compound ID |
CP0511941
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| Compound Name |
3-[methyl-[6-(4-phenylpiperidin-1-yl)hexyl]amino]phenol;hydrochloride
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| Structure |
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| Formula |
C24H34N2O
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| Molecular Weight |
366.549
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| Canonical SMILES |
CN(CCCCCCN1CCC(CC1)c1ccccc1)c1cccc(O)c1
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| InChI |
InChI=1S/C24H34N2O.ClH/c1-25(23-12-9-13-24(27)20-23)16-7-2-3-8-17-26-18-14-22(15-19-26)21-10-5-4-6-11-21;/h4-6,9-13,20,22,27H,2-3,7-8,14-19H2,1H3;1H
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| InChIKey |
NEKFBDFCNJFLIS-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