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atrazine

Identification (Source:EPA,EU)

ID	1110
Name	atrazine
CAS	1912-24-9
IUPAC
Inchi	InChI=1S/C8H14ClN5/c1-4-10-7-12-6(9)13-8(14-7)11-5(2)3/h5H,4H2,1-3H3,(H2,10,11,12,13,14)
CIPAC	91
EPA Code	080803
Formula	C8H14ClN5
SMILES	Clc1nc(nc(n1)NC(C)C)NCC
Status	Not Approved

Classification

Mode of Action	Selective, systemic action with residual and foliar activity. Inhibits photosynthesis (photosystem II).
Pesticide Type	Herbicide
Chemical Group	Triazine
Classification	chlorotriazine herbicides

Properties (Source:PubChem)

Molecular Weight	215.68
Physical State	White crystals
AlogP	1.59
H-Bond Donor	2
H-Bond Acceptor	5
Surface Area	224.79
Polar Surface Area	62.73

Structure

Ecotoxicology (Source:PPDB,IPM)

Species	Method	Study Time	Dose Type	Value
Algae	Acute	72 hour	EC50, growth	0.059 mg l-1
Algae	Chronic	96 hour	NOEC, growth	0.1 mg l-1
Aquatic crustaceans	Acute	96 hour	LC50	1.0 mg l-1
Aquatic invertebrates	Chronic	21 day	NOEC	0.25 mg l-1
Aquatic invertebrates	Acute	48 hour	EC50	85 mg l-1
Aquatic plants	Acute	7 day	EC50, biomass	0.019 mg l-1
Birds	Acute		LD50	4237 mg kg-1
Earthworms	Acute	14 day	LD50	79 mg kg-1
Fish	Chronic	21 day	NOEC	2 mg l-1
Fish	Acute	96 hour	LC50	4.5 mg l-1
Honeybees	Acute	48 hour	LD50	100 μg bee-1
Mammals	Acute oral		LD50	1869 mg kg-1
Mammals	Short term dietary		NOEL	200 ppm diet
Sediment dwelling organisms	Acute	96 hour	LC50	1.0 mg l-1
	Bio-concentration factor		CT50	Not available days
	Bio-concentration factor		BCF	4.3

Related targets

Target Name	RScore (About this table)
SF 1	536(6,6,13,21)	Details
cytochrome P450 (protein family or complex)	565(5,7,18,50)	Details
glutathione S transferase	561(3,9,26,56)	Details
Acetylcholinesterase	368(3,5,13,28)	Details
lysozyme	246(3,3,3,6)	Details
ATPase	245(3,3,3,5)	Details
estrogen receptors	327(2,6,8,37)	Details
protein a	244(2,4,6,14)	Details
androgen receptor	208(2,3,5,8)	Details
alkaline phosphatase	207(2,3,4,12)	Details
IL 6	196(2,3,3,6)	Details
catalase	243(2,2,13,28)	Details
CYP1A1	216(2,2,8,26)	Details
PS1	171(2,2,3,6)	Details
acetolactate synthase	165(2,2,2,5)	Details
tyrosine hydroxylase	165(2,2,2,5)	Details
phosphodiesterase	165(2,2,2,5)	Details
glutathione S transferase P	164(2,2,2,4)	Details
MIPP	163(2,2,2,3)	Details
complex is	162(2,2,2,2)	Details
somatostatin	162(2,2,2,2)	Details
hemoglobin (protein family or complex)	210(1,4,9,15)	Details
TC1	181(1,3,7,21)	Details
albumin	137(1,2,6,7)	Details
acid phosphatase	121(1,2,3,6)	Details
SA1	119(1,2,3,4)	Details
IL 5	114(1,2,2,4)	Details
gonadotropin releasing hormone receptor	112(1,2,2,2)	Details
C18	164(1,1,7,54)	Details
CYP1A2	90(1,1,1,10)	Details
immunoglobulin (protein family or complex)	89(1,1,2,4)	Details
ha 1	88(1,1,2,3)	Details
apoprotein	84(1,1,1,4)	Details
CDMT	84(1,1,1,4)	Details
P19	84(1,1,1,4)	Details
ERbeta	84(1,1,1,4)	Details
NNAT	82(1,1,1,2)	Details
ACF	82(1,1,1,2)	Details
brains	82(1,1,1,2)	Details
DCIP	81(1,1,1,1)	Details
hexokinase	81(1,1,1,1)	Details
ScFvs	223(0,6,8,33)	Details
Koc	112(0,2,8,22)	Details
dopamine beta hydroxylase	62(0,2,2,2)	Details
G protein coupled receptor 30	55(0,1,4,10)	Details
Tyrosinase	45(0,1,2,10)	Details
chitinase	44(0,1,2,9)	Details
FAME	38(0,1,2,3)	Details
TNFalpha	37(0,1,2,2)	Details
hormone receptor	35(0,1,1,5)	Details
INAP	34(0,1,1,4)	Details
serum cholinesterase	34(0,1,1,4)	Details
ETHA	31(0,1,1,1)	Details
transcription factor AP 1	31(0,1,1,1)	Details
epidermal growth factor receptor	31(0,1,1,1)	Details
interferon gamma	31(0,1,1,1)	Details
TLR3	31(0,1,1,1)	Details
elastin	31(0,1,1,1)	Details
Lipoxygenase (protein family or complex)	31(0,1,1,1)	Details
aquaporin (protein family or complex)	31(0,1,1,1)	Details
CYP19	46(0,0,5,21)	Details
superoxide dismutase	34(0,0,4,14)	Details
NF90	26(0,0,4,6)	Details

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