General Information of the Compound
| Compound ID |
CP0416787
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| Compound Name |
N-hydroxy-5-[3-[(5-phenylthiophene-2-carbonyl)amino]propyl]-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxamide
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| Structure |
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| Formula |
C21H22N4O3S2
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| Molecular Weight |
442.566
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| Canonical SMILES |
ONC(=O)c1nc2CCN(CCCNC(=O)c3ccc(s3)-c3ccccc3)Cc2s1
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| InChI |
InChI=1S/C21H22N4O3S2/c26-19(17-8-7-16(29-17)14-5-2-1-3-6-14)22-10-4-11-25-12-9-15-18(13-25)30-21(23-15)20(27)24-28/h1-3,5-8,28H,4,9-13H2,(H,22,26)(H,24,27)
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| InChIKey |
UNAMALAEOWCFPX-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