General Information of the Compound
| Compound ID |
CP0148379
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| Compound Name |
6-[1-(4-Hydroxy-benzyl)-propyl]-pyridin-3-ol
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| Structure |
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| Formula |
C15H17NO2
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| Molecular Weight |
243.306
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| Canonical SMILES |
CCC(Cc1ccc(O)cc1)c1ccc(O)cn1
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| InChI |
InChI=1S/C15H17NO2/c1-2-12(15-8-7-14(18)10-16-15)9-11-3-5-13(17)6-4-11/h3-8,10,12,17-18H,2,9H2,1H3
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| InChIKey |
FDYBANGDFXKEOP-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: PT00886, Estrogen receptor
Protein ID: PT00889, Estrogen receptor beta