General Information of the Compound
| Compound ID |
CP0411840
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| Compound Name |
4'-(Pyridin-4-ylmethyl)biphenyl-3,4-diol
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| Synonyms |
4'-(Pyridin-4-ylmethyl)biphenyl-3,4-diol
BDBM50322793
CHEMBL1172779
SCHEMBL18770369
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| Structure |
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| Formula |
C18H15NO2
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| Molecular Weight |
277.323
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| Canonical SMILES |
Oc1ccc(cc1O)-c1ccc(Cc2ccncc2)cc1
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| InChI |
InChI=1S/C18H15NO2/c20-17-6-5-16(12-18(17)21)15-3-1-13(2-4-15)11-14-7-9-19-10-8-14/h1-10,12,20-21H,11H2
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| InChIKey |
KOYRCBKCALKGKO-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: PT03119, Cytochrome P450 11B1, mitochondrial
Protein ID: PT03120, Cytochrome P450 11B2, mitochondrial
Clinical Information about the Compound