General Information of the Compound
| Compound ID |
CP0418696
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| Compound Name |
(trans-4-Isopropylcyclohexyl)(1-(2-morpholinoethyl)-1H-indol-3-yl)methanone
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| Formula |
C24H34N2O2
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| Molecular Weight |
382.548
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| Canonical SMILES |
CC(C)[C@H]1CC[C@@H](CC1)C(=O)c1cn(CCN2CCOCC2)c2ccccc12
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| InChI |
InChI=1S/C24H34N2O2/c1-18(2)19-7-9-20(10-8-19)24(27)22-17-26(23-6-4-3-5-21(22)23)12-11-25-13-15-28-16-14-25/h3-6,17-20H,7-16H2,1-2H3/t19-,20-
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| InChIKey |
BNAHRZBQOFOAKQ-MXVIHJGJSA-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