General Information of the Compound
| Compound ID |
CP0429518
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| Compound Name |
4-hydroxy-N-(2-hydroxy-2-phenylpropyl)-N-propan-2-ylbenzenesulfonamide
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| Structure |
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| Formula |
C18H23NO4S
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| Molecular Weight |
349.452
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| Canonical SMILES |
CC(C)N(CC(C)(O)c1ccccc1)S(=O)(=O)c1ccc(O)cc1
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| InChI |
InChI=1S/C18H23NO4S/c1-14(2)19(13-18(3,21)15-7-5-4-6-8-15)24(22,23)17-11-9-16(20)10-12-17/h4-12,14,20-21H,13H2,1-3H3
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| InChIKey |
CMKSCKCUAREBBC-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
Protein ID: PT00886, Estrogen receptor
Protein ID: PT00889, Estrogen receptor beta