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N3(C(C2(=C(C=C(C1(=CC=CC=C1))C=C2)CC3))C)

Molecule Name:	32398
Refractivity:	72.17
Resonant Structures:	1
topological PSA:	12.03
ASA hydrophobic:	419.99
ASA polar:	7.30
Accessible Surface Area:	427.29
cLogS:	-3.998
MW:	223.318
cLogP:	3.6189
H-Acceptors:	1
H-Donors:	1
Ro5 violations:	0
DrugScore:	0.753875586
Druglikeness:	3.4892
Irritant:	none
Mutagenic:	none
Reproductive Effective:	none
Tumorigenic:	none
Fish Toxicity:	High FHMT
Fish Toxicity2:	1.72
Rat Acute Toxicity:	2.6721
Acute Oral Toxicity:	II
Caco-2 Permeability:	Caco2+
Caco-2 Permeability2:	1.471
P-glycoprotein Inhibitor2:	Substrate
P-glycoprotein Inhibitor:	Non-inhibitor
P-glycoprotein Inhibitor2:	Non-inhibitor
Human Ether-a-go-go-Related Gene Inhibition:	Weak inhibitor
Human Ether-a-go-go-Related Gene Inhibition2:	Inhibitor
CYP450 2C9 Substrate:	Non-substrate
Tetrahymena Pyriformis Toxicity :	High TPT
Tetrahymena Pyriformis Toxicity2:	0.6282
AMES Toxicity:	Non AMES toxic
CYP450 3A4 Inhibitor:	Non-substrate
CYP450 3A4 Substrate:	Non-inhibitor
CYP450 2C19 Inhibitor:	Non-inhibitor
CYP450 2C9 Inhibitor:	Non-inhibitor
CYP450 2D6 Inhibitor:	Inhibitor
CYP450 1A2 Inhibitor:	Inhibitor
CYP450 2D6 Substrate:	Substrate
Biodegradation:	Not ready biodegradable
Carcinogens:	Non-carcinogens
Blood-Brain Barrier:	BBB+
CYP Inhibitory Promiscuity:	Low CYP Inhibitory Promiscuity
Honey Bee Toxicity:	Low HBT
Renal Organic Cation Transporter:	Inhibitor
Carcinogenicity (Three-class):	Non-required
Human Intestinal Absorption:	HIA+

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