General Information of the Compound
| Compound ID |
CP0858814
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| Compound Name |
(E)-6-Naphthalen-2-yl-4-oxohex-5-enoic acid
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| Structure |
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| Formula |
C16H14O3
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| Molecular Weight |
254.285
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| Canonical SMILES |
O=C(O)CCC(=O)/C=C/c1ccc2ccccc2c1
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| InChI |
InChI=1S/C16H14O3/c17-15(9-10-16(18)19)8-6-12-5-7-13-3-1-2-4-14(13)11-12/h1-8,11H,9-10H2,(H,18,19)/b8-6+
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| InChIKey |
QWXZWGIRNZRBGH-SOFGYWHQSA-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
Protein ID: PT01298, Cannabinoid receptor 1
Protein ID: PT00834, Cannabinoid receptor 2