General Information of the Compound
| Compound ID |
CP0850828
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| Compound Name |
N-(2-(3-(trifluoromethyl)phenylcarbamoyl)phenyl)isoxazole-5-carboxamide
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| Structure |
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| Formula |
C18H12F3N3O3
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| Molecular Weight |
375.306
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| Canonical SMILES |
O=C(Nc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1)c1ccno1
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| InChI |
InChI=1S/C18H12F3N3O3/c19-18(20,21)11-4-3-5-12(10-11)23-16(25)13-6-1-2-7-14(13)24-17(26)15-8-9-22-27-15/h1-10H,(H,23,25)(H,24,26)
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| InChIKey |
UAFOUFFGKXPUIQ-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: PT05999, Relaxin receptor 1
Protein ID: PT06657, Relaxin receptor 2