General Information of the Compound
| Compound ID |
CP0523527
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| Compound Name |
2-[1-acetyl-3-[[4-[(2-ethylquinolin-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 |
CCc1cc(COc2ccc(cc2)S(=O)(=O)NC2(CC(=O)NO)CN(C2)C(C)=O)c2ccccc2n1
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| InChI |
InChI=1S/C25H28N4O6S/c1-3-19-12-18(22-6-4-5-7-23(22)26-19)14-35-20-8-10-21(11-9-20)36(33,34)28-25(13-24(31)27-32)15-29(16-25)17(2)30/h4-12,28,32H,3,13-16H2,1-2H3,(H,27,31)
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| InChIKey |
KSACAACEFMKHQW-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