General Information of the Compound
| Compound ID |
CP0502505
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| Compound Name |
1-(5-hydroxy-2-(2-hydroxy-3-(piperidin-1-yl)propoxy)phenyl)-3-phenylpropan-1-one
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| Structure |
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| Formula |
C23H29NO4
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| Molecular Weight |
383.488
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| Canonical SMILES |
OC(COc1ccc(O)cc1C(=O)CCc1ccccc1)CN1CCCCC1
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| InChI |
InChI=1S/C23H29NO4/c25-19-10-12-23(28-17-20(26)16-24-13-5-2-6-14-24)21(15-19)22(27)11-9-18-7-3-1-4-8-18/h1,3-4,7-8,10,12,15,20,25-26H,2,5-6,9,11,13-14,16-17H2
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| InChIKey |
HNTYJJIDGXCTPP-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