General Information of the Compound
| Compound ID |
CP0564167
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| Compound Name |
5-[4-[(Z)-1-[4-[2-(dimethylamino)ethoxy]phenyl]-1-(4-hydroxyphenyl)but-1-en-2-yl]phenoxy]-N-hydroxypentanamide
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| Structure |
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| Formula |
C31H38N2O5
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| Molecular Weight |
518.654
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| Canonical SMILES |
CC\C(=C(/c1ccc(O)cc1)c1ccc(OCCN(C)C)cc1)c1ccc(OCCCCC(=O)NO)cc1
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| InChI |
InChI=1S/C31H38N2O5/c1-4-29(23-10-16-27(17-11-23)37-21-6-5-7-30(35)32-36)31(24-8-14-26(34)15-9-24)25-12-18-28(19-13-25)38-22-20-33(2)3/h8-19,34,36H,4-7,20-22H2,1-3H3,(H,32,35)/b31-29-
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| InChIKey |
AGDNILXHLCBNFK-YCNYHXFESA-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