General Information of the Compound
| Compound ID |
CP0542290
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| Compound Name |
N-[4-[(1-butanoylpiperidin-4-yl)sulfamoyl]naphthalen-1-yl]-4-pentylbenzamide
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| Structure |
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| Formula |
C31H39N3O4S
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| Molecular Weight |
549.737
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| Canonical SMILES |
CCCCCc1ccc(cc1)C(=O)Nc1ccc(c2ccccc12)S(=O)(=O)NC1CCN(CC1)C(=O)CCC
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| InChI |
InChI=1S/C31H39N3O4S/c1-3-5-6-10-23-13-15-24(16-14-23)31(36)32-28-17-18-29(27-12-8-7-11-26(27)28)39(37,38)33-25-19-21-34(22-20-25)30(35)9-4-2/h7-8,11-18,25,33H,3-6,9-10,19-22H2,1-2H3,(H,32,36)
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| InChIKey |
ZGKUKXPHLCLKQW-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