General Information of the Compound
| Compound ID |
CP0497456
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| Compound Name |
3-Chloro-N-[4-(pyrrolidine-1-carbonyl)benzyl]benzenesulfonamide
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| Structure |
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| Formula |
C18H19ClN2O3S
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| Molecular Weight |
378.881
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| Canonical SMILES |
Clc1cccc(c1)S(=O)(=O)NCc1ccc(cc1)C(=O)N1CCCC1
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| InChI |
InChI=1S/C18H19ClN2O3S/c19-16-4-3-5-17(12-16)25(23,24)20-13-14-6-8-15(9-7-14)18(22)21-10-1-2-11-21/h3-9,12,20H,1-2,10-11,13H2
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| InChIKey |
ZGDLYYSRXDDQDA-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: PT01109, 11-beta-hydroxysteroid dehydrogenase 1
Protein ID: PT01107, 11-beta-hydroxysteroid dehydrogenase 1