General Information of the Compound
| Compound ID |
CP0078199
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| Compound Name |
(4-methoxyphenyl)-[1-(oxan-4-ylmethyl)-5-propoxyindol-3-yl]methanone
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| Structure |
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| Formula |
C25H29NO4
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| Molecular Weight |
407.51
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| Canonical SMILES |
CCCOc1ccc2n(CC3CCOCC3)cc(C(=O)c3ccc(OC)cc3)c2c1
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| InChI |
InChI=1S/C25H29NO4/c1-3-12-30-21-8-9-24-22(15-21)23(17-26(24)16-18-10-13-29-14-11-18)25(27)19-4-6-20(28-2)7-5-19/h4-9,15,17-18H,3,10-14,16H2,1-2H3
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| InChIKey |
HASICPCOVYESAH-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
Protein ID: PT01298, Cannabinoid receptor 1
Protein ID: PT00834, Cannabinoid receptor 2