General Information of the Compound
| Compound ID |
CP0109562
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| Compound Name |
(1S,2R)-1-ethyl-N-hydroxy-2-[methyl-[4-[(2-methylquinolin-4-yl)methoxy]phenyl]sulfonylamino]cyclopentane-1-carboxamide
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| Structure |
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| Formula |
C26H31N3O5S
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| Molecular Weight |
497.617
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| Canonical SMILES |
CC[C@@]1(CCC[C@H]1N(C)S(=O)(=O)c1ccc(OCc2cc(C)nc3ccccc23)cc1)C(=O)NO
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| InChI |
InChI=1S/C26H31N3O5S/c1-4-26(25(30)28-31)15-7-10-24(26)29(3)35(32,33)21-13-11-20(12-14-21)34-17-19-16-18(2)27-23-9-6-5-8-22(19)23/h5-6,8-9,11-14,16,24,31H,4,7,10,15,17H2,1-3H3,(H,28,30)/t24-,26+/m1/s1
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| InChIKey |
HSFNYQQMBCDKTR-RSXGOPAZSA-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