General Information of the Compound
| Compound ID |
CP0507429
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| Compound Name |
(1S,2S)-N-[(1S)-1-(6-methylsulfonylpyridin-3-yl)ethyl]-2-phenylcyclopropane-1-carboxamide
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| Structure |
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| Formula |
C18H20N2O3S
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| Molecular Weight |
344.436
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| Canonical SMILES |
C[C@H](NC(=O)[C@H]1C[C@@H]1c1ccccc1)c1ccc(nc1)S(C)(=O)=O
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| InChI |
InChI=1S/C18H20N2O3S/c1-12(14-8-9-17(19-11-14)24(2,22)23)20-18(21)16-10-15(16)13-6-4-3-5-7-13/h3-9,11-12,15-16H,10H2,1-2H3,(H,20,21)/t12-,15+,16-/m0/s1
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| InChIKey |
QFSSAQYDZVUDBE-MAZHCROVSA-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