General Information of the Compound
| Compound ID |
CP0483333
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| Compound Name |
1-(2,3-dimethylindazol-5-yl)-4-[[5-(trifluoromethyl)thiophen-3-yl]methoxy]pyridin-2-one
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| Structure |
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| Formula |
C20H16F3N3O2S
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| Molecular Weight |
419.428
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| Canonical SMILES |
Cc1n(C)nc2ccc(cc12)-n1ccc(OCc2csc(c2)C(F)(F)F)cc1=O
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| InChI |
InChI=1S/C20H16F3N3O2S/c1-12-16-8-14(3-4-17(16)24-25(12)2)26-6-5-15(9-19(26)27)28-10-13-7-18(29-11-13)20(21,22)23/h3-9,11H,10H2,1-2H3
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| InChIKey |
HCPZBYNMKVQXBT-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: PT01388, Melanin-concentrating hormone receptor 1
Protein ID: PT01027, Melanin-concentrating hormone receptor 1