General Information of the Compound
| Compound ID |
CP0560068
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| Compound Name |
CHEMBL4217146
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| Formula |
C20H28N2O4
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| Molecular Weight |
360.454
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| Canonical SMILES |
OC(=O)c1ccc(O[C@H]2CC[C@@H](CC2)NC(=O)NC2CCCCC2)cc1
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| InChI |
InChI=1S/C20H28N2O4/c23-19(24)14-6-10-17(11-7-14)26-18-12-8-16(9-13-18)22-20(25)21-15-4-2-1-3-5-15/h6-7,10-11,15-16,18H,1-5,8-9,12-13H2,(H,23,24)(H2,21,22,25)/t16-,18-
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| InChIKey |
OVKYOOTTWMYNIV-SAABIXHNSA-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: PT01103, Bifunctional epoxide hydrolase 2
Protein ID: PT01099, Fatty-acid amide hydrolase 1