General Information of the Compound
| Compound ID |
CP0416549
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| Compound Name |
3-[4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]-1-(4-hydroxyphenyl)but-1-en-2-yl]phenyl]-N-hydroxypropanamide
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| Structure |
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| Formula |
C29H34N2O4
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| Molecular Weight |
474.601
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| Canonical SMILES |
CC\C(=C(/c1ccc(O)cc1)c1ccc(OCCN(C)C)cc1)c1ccc(CCC(=O)NO)cc1
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| InChI |
InChI=1S/C29H34N2O4/c1-4-27(22-8-5-21(6-9-22)7-18-28(33)30-34)29(23-10-14-25(32)15-11-23)24-12-16-26(17-13-24)35-20-19-31(2)3/h5-6,8-17,32,34H,4,7,18-20H2,1-3H3,(H,30,33)/b29-27-
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| InChIKey |
BTFOIATUJNDIIR-OHYPFYFLSA-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