General Information of the Compound
| Compound ID |
CP0424086
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| Compound Name |
(2S)-N-hydroxy-2-[[1-[1-(2-methoxyphenyl)ethyl]triazol-4-yl]methylcarbamoylamino]-4-methylpentanamide
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| Structure |
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| Formula |
C19H28N6O4
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| Molecular Weight |
404.471
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| Canonical SMILES |
COc1ccccc1C(C)n1cc(CNC(=O)N[C@@H](CC(C)C)C(=O)NO)nn1
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| InChI |
InChI=1S/C19H28N6O4/c1-12(2)9-16(18(26)23-28)21-19(27)20-10-14-11-25(24-22-14)13(3)15-7-5-6-8-17(15)29-4/h5-8,11-13,16,28H,9-10H2,1-4H3,(H,23,26)(H2,20,21,27)/t13?,16-/m0/s1
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| InChIKey |
XYTMRDRBLGUEDP-VYIIXAMBSA-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