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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
Species: 4932
Condition: SMI1
Replicates: 2
Raw OD Value: r im 0.4132±0.0362746
Normalized OD Score: sc h 0.6292±0.00228509
Z-Score: -10.1558±0.745201
p-Value: 3.02066e-22
Z-Factor: 0.744312
Fitness Defect: 49.5514
Bioactivity Statement: Active
Experimental Conditions
Library:Lopac
Plate Number and Position:3|A11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.10 Celcius
Date:2005-11-15 YYYY-MM-DD
Plate CH Control (+):0.03875±0.00131
Plate DMSO Control (-):0.6553249999999999±0.01905
Plate Z-Factor:0.9126
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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

active | Cluster 11809 | Additional Members: 3 | Rows returned: 1
SPE01503203 0

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