General Information of the Compound
| Compound ID |
CP0524631
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| Compound Name |
N-[4-[(1-butanoylpiperidin-4-yl)sulfamoyl]naphthalen-1-yl]pyridine-3-carboxamide
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| Structure |
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| Formula |
C25H28N4O4S
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| Molecular Weight |
480.59
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| Canonical SMILES |
CCCC(=O)N1CCC(CC1)NS(=O)(=O)c1ccc(NC(=O)c2cccnc2)c2ccccc12
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| InChI |
InChI=1S/C25H28N4O4S/c1-2-6-24(30)29-15-12-19(13-16-29)28-34(32,33)23-11-10-22(20-8-3-4-9-21(20)23)27-25(31)18-7-5-14-26-17-18/h3-5,7-11,14,17,19,28H,2,6,12-13,15-16H2,1H3,(H,27,31)
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| InChIKey |
GZQRNMNMUFHNJZ-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