General Information of the Compound
| Compound ID |
CP0957242
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| Compound Name |
1-[3-(4-Cyclohexylmethyl-phenoxy)-propyl]-piperidine
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| Structure |
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| Formula |
C21H33NO
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| Molecular Weight |
315.501
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| Canonical SMILES |
c1cc(OCCCN2CCCCC2)ccc1CC1CCCCC1
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| InChI |
InChI=1S/C21H33NO/c1-3-8-19(9-4-1)18-20-10-12-21(13-11-20)23-17-7-16-22-14-5-2-6-15-22/h10-13,19H,1-9,14-18H2
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| InChIKey |
YBCVPRKLVDEIOJ-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