General Information of the Compound
| Compound ID |
CP0081815
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| Compound Name |
(1S,2R)-1-ethyl-N-hydroxy-2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylamino]cyclopentane-1-carboxamide
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| Structure |
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| Formula |
C25H29N3O5S
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| Molecular Weight |
483.59
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| Canonical SMILES |
CC[C@@]1(CCC[C@H]1NS(=O)(=O)c1ccc(OCc2cc(C)nc3ccccc23)cc1)C(=O)NO
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| InChI |
InChI=1S/C25H29N3O5S/c1-3-25(24(29)27-30)14-6-9-23(25)28-34(31,32)20-12-10-19(11-13-20)33-16-18-15-17(2)26-22-8-5-4-7-21(18)22/h4-5,7-8,10-13,15,23,28,30H,3,6,9,14,16H2,1-2H3,(H,27,29)/t23-,25+/m1/s1
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| InChIKey |
VIJDVTZXENDHBS-NOZRDPDXSA-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