biphenyl

Identification (Source:EPA,EU)

ID 477
Name biphenyl
CAS 92-52-4
IUPAC biphenyl
Inchi InChI=1S/C12H10/c1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1-10H
CIPAC None allocated
EPA Code 017002
Formula C12H10
SMILES c1cc(ccc1)c2ccccc2
Status Not Approved

Classification

Mode of Action Inhibits sporulation
Pesticide Type Fungicide
Chemical Group Aromatic hydrocarbon
Classification aromatic fungicides

Properties (Source:PubChem)

Molecular Weight 154.21
Physical State Colourless crystals
AlogP 3.348
H-Bond Donor 0
H-Bond Acceptor 0
Surface Area 153.37
Polar Surface Area 0.0

Structure



ChemMapper Search Option (Docunmentation of ChemMapper)

3D similarity method

2D similarity method

Compound Database



Bioactivity Database

KEGG (5,928)

PDB (7,072)


Similarity Threshold

Ecotoxicology (Source:PPDB,IPM)

Species Method Study Time Dose Type Value
Algae Acute 72 hour EC50, growth 1.3 mg l-1
Aquatic invertebrates Acute 48 hour EC50 2.38 mg l-1
Aquatic invertebrates Chronic 21 day NOEC 0.17 mg l-1
Fish Acute 96 hour LC50 1.5 mg l-1
Mammals Acute oral LD50 2140 mg kg-1
Bio-concentration factor CT50 Not available days
Bio-concentration factor BCF 2700

Related targets

Target Name RScore (About this table)
Fatty acid amide hydrolase 456(2,10,11,51) Details
peroxisome proliferator activated receptor gamma 311(2,5,6,56) Details
angiotensin II 356(2,3,3,166) Details
anticholinesterase 204(2,3,3,14) Details
5 lipoxygenase 200(2,3,3,10) Details
cytochrome P450 (protein family or complex) 190(2,2,4,20) Details
P gp 182(2,2,3,17) Details
cyclooxygenase 1 162(2,2,2,2) Details
transthyretin 149(1,3,3,9) Details
Factor Xa 147(1,3,3,7) Details
Ah receptor 141(1,2,2,31) Details
mGlu2 124(1,2,2,14) Details
squalene synthase 121(1,2,2,11) Details
dihydrofolate reductase 119(1,2,2,9) Details
carbonic anhydrase 118(1,2,2,8) Details
Growth hormone secretagogues 118(1,2,2,8) Details
bradykinin 113(1,2,2,3) Details
lipase 90(1,1,1,10) Details
angiotensin converting enzyme 2 89(1,1,1,9) Details
BLT2 87(1,1,1,7) Details
NK1 84(1,1,1,4) Details
beta catenin 84(1,1,1,4) Details
glutamate receptors (protein family or complex) 83(1,1,1,3) Details
MMP 2 82(1,1,1,2) Details
MP2 82(1,1,1,2) Details
microsomal triglyceride transfer protein 81(1,1,1,1) Details
matrix metalloproteinase 13 81(1,1,1,1) Details
lipase a 81(1,1,1,1) Details
p38 141(0,4,4,21) Details
p38alpha 131(0,4,4,11) Details
estrogen receptors 110(0,3,3,20) Details
beta 3 adrenergic receptor 97(0,3,3,7) Details
peroxisome proliferator activated receptor alpha 96(0,2,2,36) Details
albumin 89(0,2,2,29) Details
yl 1 86(0,2,6,6) Details
5 HT1B receptor 80(0,2,2,20) Details
gamma secretase (protein family or complex) 70(0,2,3,5) Details
MCH1R 70(0,2,2,10) Details
Ghrelin receptor 67(0,2,2,7) Details
transferase 67(0,2,2,7) Details
acetylcholine receptor (protein family or complex) 65(0,2,2,5) Details
trypsin like serine protease 62(0,2,2,2) Details
eta 1 62(0,2,2,2) Details
Tyrosinase 65(0,1,1,35) Details
NMDA receptors (protein family or complex) 50(0,1,1,20) Details
NK 1 receptor 45(0,1,1,15) Details
histone deacetylases (protein family or complex) 43(0,1,1,13) Details
HDAC 42(0,1,1,12) Details
cycloxygenase 2 41(0,1,1,11) Details
dihydroorotate dehydrogenase 38(0,1,1,8) Details
DP2 36(0,1,1,6) Details
protein kinase B 35(0,1,1,5) Details
5 HT 1A 35(0,1,1,5) Details
G protein 35(0,1,1,5) Details
cyclin dependent kinase (protein family or complex) 35(0,1,1,5) Details
fibronectin 35(0,1,1,5) Details
S1P 34(0,1,1,4) Details
5 HT2B 34(0,1,1,4) Details
Tcf 4 34(0,1,1,4) Details
muscles 34(0,1,1,4) Details
C10 33(0,1,1,3) Details
cytochrome P450 1B1 33(0,1,1,3) Details
bombesin receptor subtype 3 33(0,1,1,3) Details
glycine receptor (protein family or complex) 33(0,1,1,3) Details
alpha1 adrenoceptor (protein family or complex) 32(0,1,1,2) Details
guanylate cyclase 32(0,1,1,2) Details
ferredoxin reductase 32(0,1,1,2) Details
cholecystokinin 32(0,1,1,2) Details
dipeptidyl peptidase IV 32(0,1,1,2) Details
MAP kinase 32(0,1,1,2) Details
aggrecanase 1 32(0,1,1,2) Details
CHK1 32(0,1,1,2) Details
small G protein 31(0,1,1,1) Details
Pr 3 31(0,1,1,1) Details
thyroid hormone receptor (protein family or complex) 31(0,1,1,1) Details
steroid sulfatase 31(0,1,1,1) Details
Nerve growth factor 31(0,1,1,1) Details
bcl 2 182(0,0,1,177) Details
Bcl xL 66(0,0,0,66) Details
mcl 1 56(0,0,0,56) Details
FRAP 46(0,0,0,46) Details
catalase 34(0,0,1,29) Details
Cathepsin K 34(0,0,0,34) Details
superoxide dismutase 33(0,0,0,33) Details
caspase 3 32(0,0,0,32) Details
AT1 27(0,0,0,27) Details
vascular endothelial growth factor 26(0,0,1,21) Details
CYP1A1 26(0,0,2,16) Details
caspase (protein family or complex) 23(0,0,0,23) Details
mitogen activated protein kinase (protein family or complex) 22(0,0,0,22) Details
cytochrome c 22(0,0,0,22) Details
tumor necrosis factor 22(0,0,0,22) Details
TRAIL 21(0,0,0,21) Details
adiponectin 20(0,0,1,15) Details
CYP17 20(0,0,0,20) Details
EGFR 18(0,0,0,18) Details
Acetylcholinesterase 17(0,0,0,17) Details
BTG3 16(0,0,1,11) Details
neurokinin 1 16(0,0,0,16) Details
ROCK1 15(0,0,0,15) Details
glutathione S transferase 15(0,0,1,10) Details
Bcl w 14(0,0,0,14) Details
estrogen receptor beta 14(0,0,2,4) Details
TRPV1 14(0,0,0,14) Details
IL 1beta 13(0,0,0,13) Details
PC 3 13(0,0,0,13) Details
sodium iodide symporter 13(0,0,2,3) Details
intercellular adhesion molecule 1 13(0,0,0,13) Details
CDK4 12(0,0,1,7) Details
xanthine oxidase 12(0,0,0,12) Details
PI3K 11(0,0,0,11) Details
alanine aminotransferase 11(0,0,0,11) Details
ERK1 11(0,0,0,11) Details
interleukin 6 11(0,0,0,11) Details
myeloperoxidase 10(0,0,0,10) Details
CYP3A 10(0,0,0,10) Details
calcium channel (protein family or complex) 10(0,0,0,10) Details
connective tissue growth factor 9(0,0,0,9) Details
cyclin D1 9(0,0,0,9) Details
chemokine 9(0,0,0,9) Details
5 HT 2A 9(0,0,0,9) Details
Lipoxygenase (protein family or complex) 9(0,0,0,9) Details
Aurora A 9(0,0,0,9) Details
cytokeratin 18 9(0,0,0,9) Details
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