General Information of the Compound
| Compound ID |
CP0528758
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| Compound Name |
N-[2-hydroxy-5-[(2R)-2-hydroxy-3-[2-(4-methoxyphenyl)ethylamino]propoxy]phenyl]methanesulfonamide
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| Structure |
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| Formula |
C19H26N2O6S
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| Molecular Weight |
410.492
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| Canonical SMILES |
COc1ccc(CCNC[C@@H](O)COc2ccc(O)c(NS(C)(=O)=O)c2)cc1
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| InChI |
InChI=1S/C19H26N2O6S/c1-26-16-5-3-14(4-6-16)9-10-20-12-15(22)13-27-17-7-8-19(23)18(11-17)21-28(2,24)25/h3-8,11,15,20-23H,9-10,12-13H2,1-2H3/t15-/m1/s1
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| InChIKey |
BGJYDTIRALRSBD-OAHLLOKOSA-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