General Information of the Compound
| Compound ID |
CP0538631
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| Compound Name |
2-[(2R)-4-(cyclohexylmethyl)-1-(naphthalen-1-ylmethyl)piperazin-2-yl]ethanol
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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 |
OCC[C@@H]1CN(CC2CCCCC2)CCN1Cc1cccc2ccccc12
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| InChI |
InChI=1S/C24H34N2O/c27-16-13-23-19-25(17-20-7-2-1-3-8-20)14-15-26(23)18-22-11-6-10-21-9-4-5-12-24(21)22/h4-6,9-12,20,23,27H,1-3,7-8,13-19H2/t23-/m1/s1
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| InChIKey |
TZAWKCIVGVDWDQ-HSZRJFAPSA-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