General Information of the Compound
| Compound ID |
CP0374311
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| Compound Name |
N-[2-[(3-ethoxybenzoyl)amino]ethyl]-1-phenyl-3-(trifluoromethyl)pyrazole-4-carboxamide
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| Structure |
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| Formula |
C22H21F3N4O3
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| Molecular Weight |
446.429
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| Canonical SMILES |
CCOc1cccc(c1)C(=O)NCCNC(=O)c1cn(nc1C(F)(F)F)-c1ccccc1
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| InChI |
InChI=1S/C22H21F3N4O3/c1-2-32-17-10-6-7-15(13-17)20(30)26-11-12-27-21(31)18-14-29(16-8-4-3-5-9-16)28-19(18)22(23,24)25/h3-10,13-14H,2,11-12H2,1H3,(H,26,30)(H,27,31)
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| InChIKey |
GDQGNDISNUUYPE-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: PT02536, Diacylglycerol O-acyltransferase 1
Protein ID: PT02560, Diacylglycerol O-acyltransferase 1