General Information of the Compound
| Compound ID |
CP0379029
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| Compound Name |
N-[3-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]propyl]-2-phenylbenzenesulfonamide
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| Structure |
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| Formula |
C26H29ClN2O3S
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| Molecular Weight |
485.049
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| Canonical SMILES |
OC1(CCN(CCCNS(=O)(=O)c2ccccc2-c2ccccc2)CC1)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C26H29ClN2O3S/c27-23-13-11-22(12-14-23)26(30)15-19-29(20-16-26)18-6-17-28-33(31,32)25-10-5-4-9-24(25)21-7-2-1-3-8-21/h1-5,7-14,28,30H,6,15-20H2
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| InChIKey |
URMQTQIRNDXWJK-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