General Information of the Compound
| Compound ID |
CP0848730
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| Compound Name |
rac-N-(3-(Dimethylamino)propyl)-10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide 5-oxide
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| Structure |
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| Formula |
C20H23N3O3S
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| Molecular Weight |
385.489
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| Canonical SMILES |
CN(C)CCCNC(=O)c1ccc2c(c1)N(C)C(=O)c1ccccc1[S+]2[O-]
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| InChI |
InChI=1S/C20H23N3O3S/c1-22(2)12-6-11-21-19(24)14-9-10-18-16(13-14)23(3)20(25)15-7-4-5-8-17(15)27(18)26/h4-5,7-10,13H,6,11-12H2,1-3H3,(H,21,24)
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| InChIKey |
GAUDHVYNVFYMSQ-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