General Information of the Compound
| Compound ID |
CP0451216
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| Compound Name |
N-[(1S)-1-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide
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| Structure |
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| Formula |
C16H13F4N5O2
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| Molecular Weight |
383.305
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| Canonical SMILES |
C[C@H](NC(=O)c1cc(nn1C)C(F)(F)F)c1nc(no1)-c1cccc(F)c1
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| InChI |
InChI=1S/C16H13F4N5O2/c1-8(15-22-13(24-27-15)9-4-3-5-10(17)6-9)21-14(26)11-7-12(16(18,19)20)23-25(11)2/h3-8H,1-2H3,(H,21,26)/t8-/m0/s1
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| InChIKey |
AOIVCPNZJBGREF-QMMMGPOBSA-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