General Information of the Compound
| Compound ID |
CP0004941
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| Compound Name |
N-hydroxy-4-[[3-(pyrrolidin-1-ylmethyl)indol-1-yl]methyl]benzamide
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| Structure |
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| Formula |
C21H23N3O2
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| Molecular Weight |
349.434
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| Canonical SMILES |
ONC(=O)c1ccc(Cn2cc(CN3CCCC3)c3ccccc23)cc1
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| InChI |
InChI=1S/C21H23N3O2/c25-21(22-26)17-9-7-16(8-10-17)13-24-15-18(14-23-11-3-4-12-23)19-5-1-2-6-20(19)24/h1-2,5-10,15,26H,3-4,11-14H2,(H,22,25)
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| InChIKey |
MMKIXMJBZVVFRQ-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: PT00835, Histone deacetylase 2
Protein ID: PT01213, Histone deacetylase 6
Protein ID: PT01443, Polyamine deacetylase HDAC10