General Information of the Compound
| Compound ID |
CP0557703
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| Compound Name |
4-[(2-chloro-5-oxophenothiazin-10-yl)methyl]-N-hydroxybenzamide
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| Formula |
C20H15ClN2O3S
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| Molecular Weight |
398.871
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| Canonical SMILES |
ONC(=O)c1ccc(CN2c3ccccc3[S+]([O-])c3ccc(Cl)cc23)cc1
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| InChI |
InChI=1S/C20H15ClN2O3S/c21-15-9-10-19-17(11-15)23(16-3-1-2-4-18(16)27(19)26)12-13-5-7-14(8-6-13)20(24)22-25/h1-11,25H,12H2,(H,22,24)
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| InChIKey |
JNLOBRPTWNLUDP-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: PT00994, Histone deacetylase 4
Protein ID: PT01213, Histone deacetylase 6
Protein ID: PT01807, Histone deacetylase 7
Protein ID: PT01946, Histone deacetylase 9