General Information of the Compound
| Compound ID |
CP0446775
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| Compound Name |
2-[(1-tert-butyl-5-propan-2-ylpyrazol-3-yl)methyl]-3H-1,2-benzothiazole 1,1-dioxide
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| Structure |
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| Formula |
C18H25N3O2S
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| Molecular Weight |
347.484
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| Canonical SMILES |
CC(C)c1cc(CN2Cc3ccccc3S2(=O)=O)nn1C(C)(C)C
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| InChI |
InChI=1S/C18H25N3O2S/c1-13(2)16-10-15(19-21(16)18(3,4)5)12-20-11-14-8-6-7-9-17(14)24(20,22)23/h6-10,13H,11-12H2,1-5H3
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| InChIKey |
NWURBOXMBWSPTI-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: PT00897, Potassium voltage-gated channel subfamily H member 2
Protein ID: PT04557, Voltage-dependent T-type calcium channel subunit alpha-1H