General Information of the Compound
| Compound ID |
CP0430203
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| Compound Name |
4-[5-chloro-6-[(1-methylcyclopropyl)methoxy]pyridin-3-yl]-3-methoxy-N-methylsulfonylbenzamide
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| Structure |
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| Formula |
C19H21ClN2O5S
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| Molecular Weight |
424.906
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| Canonical SMILES |
COc1cc(ccc1-c1cnc(OCC2(C)CC2)c(Cl)c1)C(=O)NS(C)(=O)=O
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| InChI |
InChI=1S/C19H21ClN2O5S/c1-19(6-7-19)11-27-18-15(20)8-13(10-21-18)14-5-4-12(9-16(14)26-2)17(23)22-28(3,24)25/h4-5,8-10H,6-7,11H2,1-3H3,(H,22,23)
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| InChIKey |
LYZQTGXFFVJDIS-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: PT01105, Sodium channel protein type 5 subunit alpha
Protein ID: PT01000, Sodium channel protein type 9 subunit alpha