General Information of the Compound
| Compound ID |
CP0532159
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| Compound Name |
(3R)-6-cyclohexyl-N-hydroxy-3-(3-{[(3-pyridinylsulfonyl)amino]methyl}-1,2,4-oxadiazol-5-yl)hexanamide
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| Structure |
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| Formula |
C20H29N5O5S
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| Molecular Weight |
451.549
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| Canonical SMILES |
ONC(=O)C[C@@H](CCCC1CCCCC1)c1nc(CNS(=O)(=O)c2cccnc2)no1
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| InChI |
InChI=1S/C20H29N5O5S/c26-19(24-27)12-16(9-4-8-15-6-2-1-3-7-15)20-23-18(25-30-20)14-22-31(28,29)17-10-5-11-21-13-17/h5,10-11,13,15-16,22,27H,1-4,6-9,12,14H2,(H,24,26)/t16-/m1/s1
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| InChIKey |
QSFKIQZVLNUDND-MRXNPFEDSA-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