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Compound InformationSONAR Target prediction
Name:

Chlorprothixene hydrochloride

Unique Identifier:LOPAC 00755
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C18Cl2H19NS
Molecular Weight:333.171 g/mol
X log p:17.85  (online calculus)
Lipinksi Failures1
TPSA28.54
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:1
Rotatable Bond Count:3
Canonical Smiles:Cl.CN(C)CCC=C1c2ccccc2Sc2cc(Cl)ccc21
Class:Dopamine
Action:Antagonist
Selectivity:DRD2

Found: 7 active | as graph: single | with analogs << Back 1 2 3 4 5 6 7 Next >> 
Species: 4932
Condition: GIM3
Replicates: 4
Raw OD Value: r im 0.4300±0.157235
Normalized OD Score: sc h 0.8122±0.369282
Z-Score: -5.1276±8.83202
p-Value: 0.0000922452
Z-Factor: -89.0313
Fitness Defect: 9.2911
Bioactivity Statement: Active
Experimental Conditions
Library:Lopac
Plate Number and Position:3|A11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.50 Celcius
Date:2005-04-08 YYYY-MM-DD
Plate CH Control (+):0.04536250000000001±0.00326
Plate DMSO Control (-):0.687175±0.17262
Plate Z-Factor:-0.1671
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DBLink | Rows returned: 1
6603768 (3E)-3-(3-chlorothioxanthen-9-ylidene)-N,N-dimethyl-propan-1-amine

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 11809 | Additional Members: 3 | Rows returned: 2
SPE01503203 0
Prest754 0

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