General Information of the Compound
| Compound ID |
CP0541873
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| Compound Name |
ethyl 4-[[4-(pyridine-4-carbonylamino)naphthalen-1-yl]sulfonylamino]piperidine-1-carboxylate
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| Structure |
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| Formula |
C24H26N4O5S
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| Molecular Weight |
482.562
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| Canonical SMILES |
CCOC(=O)N1CCC(CC1)NS(=O)(=O)c1ccc(NC(=O)c2ccncc2)c2ccccc12
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| InChI |
InChI=1S/C24H26N4O5S/c1-2-33-24(30)28-15-11-18(12-16-28)27-34(31,32)22-8-7-21(19-5-3-4-6-20(19)22)26-23(29)17-9-13-25-14-10-17/h3-10,13-14,18,27H,2,11-12,15-16H2,1H3,(H,26,29)
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| InChIKey |
ZPGHKHDPDWADMY-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