General Information of the Compound
| Compound ID |
CP0508382
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| Compound Name |
5-chloro-2-fluoro-4-[[5-(4-fluorophenyl)-1,2,3,6-tetrahydropyridin-6-yl]methoxy]-N-(1,3,4-thiadiazol-2-yl)benzenesulfonamide
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| Structure |
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| Formula |
C20H17ClF2N4O3S2
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| Molecular Weight |
498.964
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| Canonical SMILES |
Fc1ccc(cc1)C1=CCCNC1COc1cc(F)c(cc1Cl)S(=O)(=O)Nc1nncs1
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| InChI |
InChI=1S/C20H17ClF2N4O3S2/c21-15-8-19(32(28,29)27-20-26-25-11-31-20)16(23)9-18(15)30-10-17-14(2-1-7-24-17)12-3-5-13(22)6-4-12/h2-6,8-9,11,17,24H,1,7,10H2,(H,26,27)
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| InChIKey |
KMIRPDVWGYDNNF-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