General Information of the Compound
| Compound ID |
CP0519388
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| Compound Name |
5-cyclopropyl-N-[1-[4-(hydroxycarbamoyl)phenyl]cyclopropyl]-2-(1,3-thiazol-2-yl)-1,3-thiazole-4-carboxamide
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| Structure |
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| Formula |
C20H18N4O3S2
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| Molecular Weight |
426.523
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| Canonical SMILES |
ONC(=O)c1ccc(cc1)C1(CC1)NC(=O)c1nc(sc1C1CC1)-c1nccs1
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| InChI |
InChI=1S/C20H18N4O3S2/c25-16(24-27)12-3-5-13(6-4-12)20(7-8-20)23-17(26)14-15(11-1-2-11)29-19(22-14)18-21-9-10-28-18/h3-6,9-11,27H,1-2,7-8H2,(H,23,26)(H,24,25)
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| InChIKey |
WVCZRDIDYOCLED-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
Protein ID: PT00991, Histone deacetylase 1
Protein ID: PT00995, Histone deacetylase 3
Protein ID: PT01213, Histone deacetylase 6