General Information of the Compound
| Compound ID |
CP0568252
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| Compound Name |
1-(2,3-dihydro-1-benzofuran-5-ylsulfonyl)-N-(2-methyl-1,3-benzothiazol-5-yl)piperidine-4-carboxamide
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| Structure |
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| Formula |
C22H23N3O4S2
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| Molecular Weight |
457.577
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| Canonical SMILES |
Cc1nc2cc(NC(=O)C3CCN(CC3)S(=O)(=O)c3ccc4OCCc4c3)ccc2s1
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| InChI |
InChI=1S/C22H23N3O4S2/c1-14-23-19-13-17(2-5-21(19)30-14)24-22(26)15-6-9-25(10-7-15)31(27,28)18-3-4-20-16(12-18)8-11-29-20/h2-5,12-13,15H,6-11H2,1H3,(H,24,26)
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| InChIKey |
VITVOTZKLJOBER-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