IBA

Identification (Source:EPA,EU)

ID 1690
Name IBA
CAS 133-32-4
IUPAC
Inchi InChI=1S/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15)
CIPAC
EPA Code
Formula C12H13NO2
SMILES O([H])C(C([H])([H])C([H])([H])C([H])([H])c(c([H])n1[H])c2c1c([H])c([H])c([H])c2[H])=O
Status Approved

Classification

Mode of Action
Pesticide Type
Chemical Group
Classification auxins

Properties (Source:PubChem)

Molecular Weight 203.23711
Physical State
AlogP 2.7
H-Bond Donor 2
H-Bond Acceptor 2
Surface Area 201.42
Polar Surface Area 53.09

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

Related targets

Target Name RScore (About this table)
galanin 488(5,7,8,23) Details
enkephalin 439(4,7,10,14) Details
G protein 384(3,6,6,54) Details
protein kinase A (protein family or complex) 239(2,4,5,14) Details
protein kinase C (protein family or complex) 209(2,3,3,19) Details
G alpha o 175(2,2,3,10) Details
calcium channel (protein family or complex) 444(1,9,17,84) Details
Nociceptin 159(1,3,4,14) Details
Mu opioid receptor 148(1,3,3,8) Details
beta adrenergic receptors (protein family or complex) 121(1,2,2,11) Details
alpha2 adrenoceptor (protein family or complex) 116(1,2,2,6) Details
adenylyl cyclase 113(1,2,2,3) Details
thrombin 90(1,1,1,10) Details
neurotensin 88(1,1,1,8) Details
thrombomodulin 88(1,1,1,8) Details
superoxide dismutase 87(1,1,1,7) Details
fatty acid desaturases (protein family or complex) 87(1,1,1,7) Details
Cav1.4alpha1 86(1,1,1,6) Details
brain derived neurotrophic factor 85(1,1,1,5) Details
kappa opioid receptors 84(1,1,1,4) Details
RGS2 84(1,1,1,4) Details
SNAP 83(1,1,1,3) Details
phospholipase A2 82(1,1,1,2) Details
Myosin 82(1,1,1,2) Details
M40 82(1,1,1,2) Details
growth hormone releasing factor 81(1,1,1,1) Details
angiotensin II 87(0,1,1,57) Details
CA1 79(0,1,1,49) Details
MAPK (protein family or complex) 40(0,1,1,10) Details
tissue type plasminogen activator 39(0,1,1,9) Details
IK1 36(0,1,1,6) Details
calcitonin gene related peptide 33(0,1,1,3) Details
Leu enkephalin 31(0,1,1,1) Details
von Willebrand factor 31(0,1,1,1) Details
muscarinic acetylcholine receptor M2 31(0,1,1,1) Details
ionized calcium binding adapter molecule 1 128(0,0,0,128) Details
CYP1A1 69(0,0,0,69) Details
fra 2 56(0,0,0,56) Details
glial fibrillary acidic protein 53(0,0,0,53) Details
tetranectin 45(0,0,0,45) Details
c fos 44(0,0,0,44) Details
transcription factor AP 1 43(0,0,0,43) Details
VEGF 43(0,0,0,43) Details
fatty acid desaturase 40(0,0,0,40) Details
AP 1 (protein family or complex) 37(0,0,0,37) Details
IL 6 32(0,0,0,32) Details
CYP1A2 31(0,0,0,31) Details
epidermal growth factor receptor 21(0,0,0,21) Details
tumor necrosis factor alpha 21(0,0,0,21) Details
Q10 20(0,0,3,5) Details
c Src 19(0,0,0,19) Details
Peroxisome proliferator activated receptors 19(0,0,0,19) Details
Cox 2 19(0,0,0,19) Details
cytochrome P450 (protein family or complex) 18(0,0,0,18) Details
miR 21 18(0,0,0,18) Details
BRG1 16(0,0,0,16) Details
laminin (protein family or complex) 15(0,0,0,15) Details
immunoglobulin (protein family or complex) 14(0,0,0,14) Details
alkaline phosphatase 14(0,0,0,14) Details
interleukin 8 13(0,0,0,13) Details
integrin 13(0,0,0,13) Details
PPARbeta 12(0,0,0,12) Details
interleukin 1beta 12(0,0,0,12) Details
c Myc 12(0,0,0,12) Details
VEGFR 2 12(0,0,0,12) Details
ADAM 12 12(0,0,0,12) Details
fibronectin 12(0,0,0,12) Details
integrin alpha M 11(0,0,0,11) Details
TSPO 11(0,0,0,11) Details
synaptophysin 11(0,0,0,11) Details
Ciliary neurotrophic factor 11(0,0,0,11) Details
AT2 10(0,0,0,10) Details
tyrosine hydroxylase 10(0,0,0,10) Details
PACAP 10(0,0,1,5) Details
cytochrome b 10(0,0,0,10) Details
Toll like receptor 4 10(0,0,0,10) Details
P60 10(0,0,0,10) Details
protein is 10(0,0,0,10) Details
SANS 9(0,0,1,4) Details
beta glucuronidase 9(0,0,0,9) Details
villin 9(0,0,0,9) Details
brains 8(0,0,0,8) Details
RIBA 8(0,0,1,3) Details
VEGF C 8(0,0,0,8) Details
thymidylate synthase 8(0,0,0,8) Details
ATPase 8(0,0,0,8) Details
CYP2E1 8(0,0,0,8) Details
VEGF D 8(0,0,0,8) Details
CD8 8(0,0,0,8) Details
phosphodiesterase 8(0,0,0,8) Details
transforming growth factor beta 1 7(0,0,0,7) Details
monocyte chemoattractant protein 1 7(0,0,0,7) Details
pancreatic lipase 7(0,0,0,7) Details
calcineurin (protein family or complex) 7(0,0,0,7) Details
vimentin 7(0,0,0,7) Details
Nerve growth factor 7(0,0,0,7) Details
Sonic hedgehog 7(0,0,0,7) Details
AT1 7(0,0,0,7) Details
adenosine A1 receptor 7(0,0,0,7) Details
activated protein C 7(0,0,0,7) Details
cytochrome c 7(0,0,0,7) Details
muscles 7(0,0,0,7) Details
Connexin 43 7(0,0,0,7) Details
coronin 1a 7(0,0,0,7) Details
NACP 7(0,0,0,7) Details
plasminogen activator inhibitor 1 7(0,0,0,7) Details
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Node List

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