General Information of the Compound
| Compound ID |
CP0012726
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| Compound Name |
5-chloro-2-fluoro-4-[[(1S)-1-(2-fluoro-5-methoxyphenyl)ethyl]amino]-N-(1,3-thiazol-4-yl)benzenesulfonamide
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| Structure |
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| Formula |
C18H16ClF2N3O3S2
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| Molecular Weight |
459.927
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| Canonical SMILES |
COc1ccc(F)c(c1)[C@H](C)Nc1cc(F)c(cc1Cl)S(=O)(=O)Nc1cscn1
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| InChI |
InChI=1S/C18H16ClF2N3O3S2/c1-10(12-5-11(27-2)3-4-14(12)20)23-16-7-15(21)17(6-13(16)19)29(25,26)24-18-8-28-9-22-18/h3-10,23-24H,1-2H3/t10-/m0/s1
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| InChIKey |
YURAPCXMUFFHQV-JTQLQIEISA-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