General Information of the Compound
Compound ID
CP0055292
Compound Name
3-(2-Naphthyl)pyridine
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Synonyms
2-(3-pyridyl)-naphthalene
3-(2-naphthyl)pyridine
3-(naphthalen-2-yl)pyridine
BDBM8904
CHEMBL365735
Pyridine-substituted naphthalene 1
SCHEMBL4510935
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Structure
Formula
C15H11N
Molecular Weight
205.26
Canonical SMILES
c1ccc2cc(ccc2c1)-c1cccnc1
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InChI
InChI=1S/C15H11N/c1-2-5-13-10-14(8-7-12(13)4-1)15-6-3-9-16-11-15/h1-11H
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InChIKey
JVWGLICJXUMGHN-UHFFFAOYSA-N
Physicochemical Property
logP
3.9018
Rotatable Bonds
1
Heavy Atom Count
16
Polar Areas
12.89
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
1
Complexity
16

"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).

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PubChem ID
CID: 11845485
SID: 17158277
ChEMBL ID
CHEMBL365735
Map of Molecular Bioactivity Related to the Compound
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
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT03119, Cytochrome P450 11B1, mitochondrial
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000170 V79MZ Cricetulus griseus (Chinese hamster)  1
1
IC50 = 5826 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 5826 nM
Protein ID: PT03120, Cytochrome P450 11B2, mitochondrial
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000170 V79MZ Cricetulus griseus (Chinese hamster)  2
1
IC50 = 28 nM
   TI
   LI
   LO
   TS
2
IC50 = 28.4 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 28 nM
Clinical Information about the Compound
Drug 1 ( 3-(naphthalen-2-yl)pyridine )
Drug Name 3-(naphthalen-2-yl)pyridine
Target(s)
Steroid 11-beta-hydroxylase (CYP11B1)
Inhibitor
Aromatase (CYP19A1)
Inhibitor