General Information of the Compound
| Compound ID |
CP0502527
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| Compound Name |
N-cyclopropyl-4-hydroxy-N-(2-hydroxy-2-phenylpropyl)benzenesulfonamide
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| Structure |
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| Formula |
C18H21NO4S
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| Molecular Weight |
347.436
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| Canonical SMILES |
CC(O)(CN(C1CC1)S(=O)(=O)c1ccc(O)cc1)c1ccccc1
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| InChI |
InChI=1S/C18H21NO4S/c1-18(21,14-5-3-2-4-6-14)13-19(15-7-8-15)24(22,23)17-11-9-16(20)10-12-17/h2-6,9-12,15,20-21H,7-8,13H2,1H3
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| InChIKey |
GYHSDCAQMDKVKI-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