General Information of the Compound
| Compound ID |
CP0446287
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| Compound Name |
3-[ethyl-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylamino]-N-hydroxy-1-(2-methylpropanoyl)azetidine-3-carboxamide
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| Structure |
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| Formula |
C27H32N4O6S
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| Molecular Weight |
540.642
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| Canonical SMILES |
CCN(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/C27H32N4O6S/c1-5-31(27(26(33)29-34)16-30(17-27)25(32)18(2)3)38(35,36)22-12-10-21(11-13-22)37-15-20-14-19(4)28-24-9-7-6-8-23(20)24/h6-14,18,34H,5,15-17H2,1-4H3,(H,29,33)
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| InChIKey |
FXODWXUWALXWSO-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