General Information of the Compound
| Compound ID |
CP0845949
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| Compound Name |
1-[1-(3-Methoxyphenyl)-2-(4-methyl-1-piperazinyl)ethyl]cyclohexanol Dihydrochloride
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| Structure |
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| Formula |
C20H34Cl2N2O2
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| Molecular Weight |
405.41
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| Canonical SMILES |
COc1cccc(C(CN2CCN(C)CC2)C2(O)CCCCC2)c1.Cl.Cl
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| InChI |
InChI=1S/C20H32N2O2.2ClH/c1-21-11-13-22(14-12-21)16-19(20(23)9-4-3-5-10-20)17-7-6-8-18(15-17)24-2;;/h6-8,15,19,23H,3-5,9-14,16H2,1-2H3;2*1H
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| InChIKey |
JHIFTPLQHSGJLO-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