General Information of the Compound
| Compound ID |
CP0394854
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| Compound Name |
1-[(3E)-3-(5-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)propyl]piperidine
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| Structure |
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| Formula |
C19H27NO
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| Molecular Weight |
285.431
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| Canonical SMILES |
COc1cccc2\C(CCCc12)=C\CCN1CCCCC1
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| InChI |
InChI=1S/C19H27NO/c1-21-19-12-6-10-17-16(8-5-11-18(17)19)9-7-15-20-13-3-2-4-14-20/h6,9-10,12H,2-5,7-8,11,13-15H2,1H3/b16-9+
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| InChIKey |
OQZQEGAAANHHRE-CXUHLZMHSA-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