General Information of the Compound
| Compound ID |
CP0918254
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| Compound Name |
5-(5-chloro-2-(4-((2S,6R)-2,6-dimethylmorpholino)phenylsulfonamido)benzoyl)-2-methylpyridine 1-oxide
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| Structure |
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| Formula |
C25H26ClN3O5S
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| Molecular Weight |
516.019
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| Canonical SMILES |
Cc1ccc(C(=O)c2cc(Cl)ccc2NS(=O)(=O)c2ccc(N3C[C@@H](C)O[C@@H](C)C3)cc2)c[n+]1[O-]
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| InChI |
InChI=1S/C25H26ClN3O5S/c1-16-4-5-19(15-29(16)31)25(30)23-12-20(26)6-11-24(23)27-35(32,33)22-9-7-21(8-10-22)28-13-17(2)34-18(3)14-28/h4-12,15,17-18,27H,13-14H2,1-3H3/t17-,18+
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| InChIKey |
VFMJIJSFZSUUSI-HDICACEKSA-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