General Information of the Compound
| Compound ID |
CP0405944
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| Compound Name |
2-phenyl-5-(pyridin-3-ylmethyl)pyridine
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| Structure |
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| Formula |
C17H14N2
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| Molecular Weight |
246.313
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| Canonical SMILES |
C(c1cccnc1)c1ccc(nc1)-c1ccccc1
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| InChI |
InChI=1S/C17H14N2/c1-2-6-16(7-3-1)17-9-8-15(13-19-17)11-14-5-4-10-18-12-14/h1-10,12-13H,11H2
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| InChIKey |
AVUOTDMJPVSEJC-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