General Information of the Compound
| Compound ID |
CP0136436
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| Compound Name |
(4-methylpiperidin-1-yl)(6-(3-(piperidin-1-yl)propoxy)naphthalen-2-yl)methanone
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| Structure |
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| Formula |
C25H34N2O2
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| Molecular Weight |
394.559
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| Canonical SMILES |
CC1CCN(CC1)C(=O)c1ccc2cc(OCCCN3CCCCC3)ccc2c1
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| InChI |
InChI=1S/C25H34N2O2/c1-20-10-15-27(16-11-20)25(28)23-7-6-22-19-24(9-8-21(22)18-23)29-17-5-14-26-12-3-2-4-13-26/h6-9,18-20H,2-5,10-17H2,1H3
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| InChIKey |
PXUAIMJAHKAYPP-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