General Information of the Compound
| Compound ID |
CP0315135
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| Compound Name |
5-chloro-2-fluoro-4-[[(1S,3R)-3-hydroxycyclohexyl]methylamino]-N-(1,3-thiazol-2-yl)benzenesulfonamide
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| Structure |
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| Formula |
C16H19ClFN3O3S2
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| Molecular Weight |
419.931
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| Canonical SMILES |
O[C@@H]1CCC[C@H](CNc2cc(F)c(cc2Cl)S(=O)(=O)Nc2nccs2)C1
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| InChI |
InChI=1S/C16H19ClFN3O3S2/c17-12-7-15(26(23,24)21-16-19-4-5-25-16)13(18)8-14(12)20-9-10-2-1-3-11(22)6-10/h4-5,7-8,10-11,20,22H,1-3,6,9H2,(H,19,21)/t10-,11+/m0/s1
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| InChIKey |
IGVXQZZYKDNDIF-WDEREUQCSA-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