General Information of the Compound
| Compound ID |
CP0520711
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| Compound Name |
(2R)-N-[2-amino-5-(4-fluorophenyl)phenyl]oxane-2-carboxamide
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| Structure |
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| Formula |
C18H19FN2O2
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| Molecular Weight |
314.36
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| Canonical SMILES |
Nc1ccc(cc1NC(=O)[C@H]1CCCCO1)-c1ccc(F)cc1
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| InChI |
InChI=1S/C18H19FN2O2/c19-14-7-4-12(5-8-14)13-6-9-15(20)16(11-13)21-18(22)17-3-1-2-10-23-17/h4-9,11,17H,1-3,10,20H2,(H,21,22)/t17-/m1/s1
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| InChIKey |
XNQXGDUSAYAYNB-QGZVFWFLSA-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