General Information of the Compound
| Compound ID |
CP0541166
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| Compound Name |
N-hydroxy-3-[2-methoxyethyl-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylamino]-1-(2-methylpropanoyl)azetidine-3-carboxamide
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| Structure |
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| Formula |
C28H34N4O7S
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| Molecular Weight |
570.668
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| Canonical SMILES |
COCCN(C1(CN(C1)C(=O)C(C)C)C(=O)NO)S(=O)(=O)c1ccc(OCc2cc(C)nc3ccccc23)cc1
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| InChI |
InChI=1S/C28H34N4O7S/c1-19(2)26(33)31-17-28(18-31,27(34)30-35)32(13-14-38-4)40(36,37)23-11-9-22(10-12-23)39-16-21-15-20(3)29-25-8-6-5-7-24(21)25/h5-12,15,19,35H,13-14,16-18H2,1-4H3,(H,30,34)
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| InChIKey |
RASNTKQSEAFGRK-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