General Information of the Compound
| Compound ID |
CP0523125
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| Compound Name |
7-fluoro-N-[1-[[3-fluoro-4-(2,2,2-trifluoroethoxy)phenyl]methyl]piperidin-4-yl]-4-oxochromene-2-carboxamide
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| Structure |
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| Formula |
C24H21F5N2O4
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| Molecular Weight |
496.432
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| Canonical SMILES |
Fc1ccc2c(c1)oc(cc2=O)C(=O)NC1CCN(Cc2ccc(OCC(F)(F)F)c(F)c2)CC1
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| InChI |
InChI=1S/C24H21F5N2O4/c25-15-2-3-17-19(32)11-22(35-21(17)10-15)23(33)30-16-5-7-31(8-6-16)12-14-1-4-20(18(26)9-14)34-13-24(27,28)29/h1-4,9-11,16H,5-8,12-13H2,(H,30,33)
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| InChIKey |
OWIABVFDMTYMSY-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: PT01027, Melanin-concentrating hormone receptor 1
Protein ID: PT00897, Potassium voltage-gated channel subfamily H member 2