General Information of the Compound
| Compound ID |
CP0419654
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| Compound Name |
[6-(diethylaminomethyl)naphthalen-2-yl]methyl N-[2,6-difluoro-4-(hydroxycarbamoyl)phenyl]carbamate
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| Formula |
C24H25F2N3O4
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| Molecular Weight |
457.477
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| Canonical SMILES |
CCN(CC)Cc1ccc2cc(COC(=O)Nc3c(F)cc(cc3F)C(=O)NO)ccc2c1
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| InChI |
InChI=1S/C24H25F2N3O4/c1-3-29(4-2)13-15-5-7-18-10-16(6-8-17(18)9-15)14-33-24(31)27-22-20(25)11-19(12-21(22)26)23(30)28-32/h5-12,32H,3-4,13-14H2,1-2H3,(H,27,31)(H,28,30)
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| InChIKey |
DMVJLNPNMRXUCQ-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