General Information of the Compound
| Compound ID |
CP0511094
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| Compound Name |
N-[5-[2-[[1-(3,4-dichlorophenyl)-2-phenylethyl]amino]-1-hydroxyethyl]-2-hydroxyphenyl]methanesulfonamide
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| Structure |
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| Formula |
C23H24Cl2N2O4S
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| Molecular Weight |
495.428
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| Canonical SMILES |
CS(=O)(=O)Nc1cc(ccc1O)C(O)CNC(Cc1ccccc1)c1ccc(Cl)c(Cl)c1
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| InChI |
InChI=1S/C23H24Cl2N2O4S/c1-32(30,31)27-21-13-17(8-10-22(21)28)23(29)14-26-20(11-15-5-3-2-4-6-15)16-7-9-18(24)19(25)12-16/h2-10,12-13,20,23,26-29H,11,14H2,1H3
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| InChIKey |
GQJAVNFENAKQBP-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