General Information of the Compound
| Compound ID |
CP0055745
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| Compound Name |
2,2,6,6-tetramethyl-4-(2-methyl-3-oxo-3,4-dihydro-2H-benzo[b][1,4]thiazine-7-carboxamido)piperidinium
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| Structure |
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| Formula |
C19H27N3O2S
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| Molecular Weight |
361.511
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| Canonical SMILES |
CC1Sc2cc(ccc2NC1=O)C(=O)NC1CC(C)(C)NC(C)(C)C1
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| InChI |
InChI=1S/C19H27N3O2S/c1-11-16(23)21-14-7-6-12(8-15(14)25-11)17(24)20-13-9-18(2,3)22-19(4,5)10-13/h6-8,11,13,22H,9-10H2,1-5H3,(H,20,24)(H,21,23)
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| InChIKey |
OIMBGIKORVUTLW-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