General Information of the Compound
| Compound ID |
CP0413711
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| Compound Name |
N-hydroxy-4-[[2-(1H-indol-3-yl)ethyl-[(2-methoxyphenyl)carbamoyl]amino]methyl]benzamide
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| Structure |
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| Formula |
C26H26N4O4
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| Molecular Weight |
458.518
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| Canonical SMILES |
COc1ccccc1NC(=O)N(CCc1c[nH]c2ccccc12)Cc1ccc(cc1)C(=O)NO
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| InChI |
InChI=1S/C26H26N4O4/c1-34-24-9-5-4-8-23(24)28-26(32)30(17-18-10-12-19(13-11-18)25(31)29-33)15-14-20-16-27-22-7-3-2-6-21(20)22/h2-13,16,27,33H,14-15,17H2,1H3,(H,28,32)(H,29,31)
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| InChIKey |
HFHTVKBHBHGTOX-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: PT01213, Histone deacetylase 6