Synonyms: LY 2087101 | LY-2087101
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors
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3
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Hydrogen bond donors
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1
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Rotatable bonds
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4
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Topological polar surface area
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98.47
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Molecular weight
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318.03
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XLogP
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3.05
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No. Lipinski's rules broken
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0
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SMILES / InChI / InChIKey
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Canonical SMILES
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Fc1ccc(cc1)Nc1nc(c(s1)C(=O)c1cscc1)C
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Isomeric SMILES
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Fc1ccc(cc1)Nc1nc(c(s1)C(=O)c1cscc1)C
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InChI
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InChI=1S/C15H11FN2OS2/c1-9-14(13(19)10-6-7-20-8-10)21-15(17-9)18-12-4-2-11(16)3-5-12/h2-8H,1H3,(H,17,18)
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InChI Key
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PEAMDZVDNYENPN-UHFFFAOYSA-N
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