General Information of the Compound
| Compound ID |
CP0415770
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| Compound Name |
2-[1-acetyl-3-[methyl-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylamino]azetidin-3-yl]-N-hydroxyacetamide
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| Structure |
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| Formula |
C25H28N4O6S
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| Molecular Weight |
512.588
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| Canonical SMILES |
CN(C1(CC(=O)NO)CN(C1)C(C)=O)S(=O)(=O)c1ccc(OCc2cc(C)nc3ccccc23)cc1
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| InChI |
InChI=1S/C25H28N4O6S/c1-17-12-19(22-6-4-5-7-23(22)26-17)14-35-20-8-10-21(11-9-20)36(33,34)28(3)25(13-24(31)27-32)15-29(16-25)18(2)30/h4-12,32H,13-16H2,1-3H3,(H,27,31)
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| InChIKey |
CQHGYKTVCAZGFO-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