General Information of the Compound
| Compound ID |
CP0498228
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| Compound Name |
N-[5-[(1R)-2-[bis(4-fluorophenyl)methylamino]-1-hydroxyethyl]-2-hydroxyphenyl]methanesulfonamide
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| Structure |
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| Formula |
C22H22F2N2O4S
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| Molecular Weight |
448.491
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| Canonical SMILES |
CS(=O)(=O)Nc1cc(ccc1O)[C@@H](O)CNC(c1ccc(F)cc1)c1ccc(F)cc1
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| InChI |
InChI=1S/C22H22F2N2O4S/c1-31(29,30)26-19-12-16(6-11-20(19)27)21(28)13-25-22(14-2-7-17(23)8-3-14)15-4-9-18(24)10-5-15/h2-12,21-22,25-28H,13H2,1H3/t21-/m0/s1
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| InChIKey |
BMXMIHXNOZCZMR-NRFANRHFSA-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