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Compound InformationSONAR Target prediction
Name:

Propionylpromazine hydrochloride

Unique Identifier:LOPAC 01155
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C20ClH25N2OS
Molecular Weight:351.746 g/mol
X log p:15.516  (online calculus)
Lipinksi Failures1
TPSA48.85
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:6
Canonical Smiles:Cl.CCC(=O)c1ccc2Sc3ccccc3N(CCCN(C)C)c2c1
Class:Dopamine
Action:Antagonist
Selectivity:DRD2

Found: 24 nonactive as graph: single | with analogs [1] << Back 1 2 3 4 5 6 7 8 9 10  Next >> [24]
Species: 4932
Condition: GIM3
Replicates: 4
Raw OD Value: r im 0.6133±0.0193267
Normalized OD Score: sc h 1.1590±0.269244
Z-Score: 2.5766±4.41816
p-Value: 0.166099
Z-Factor: -3.39758
Fitness Defect: 1.7952
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:13|D3
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.70 Celcius
Date:2005-04-08 YYYY-MM-DD
Plate CH Control (+):0.0448625±0.00062
Plate DMSO Control (-):0.6159125±0.11120
Plate Z-Factor:-0.1826
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DBLink | Rows returned: 3
24351 1-[10-(3-dimethylaminopropyl)phenothiazin-2-yl]propan-1-one hydrochloride
24352 1-[10-(3-dimethylaminopropyl)phenothiazin-2-yl]propan-1-one
6921790 dimethyl-[3-(2-propanoylphenothiazin-10-yl)propyl]azanium

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 17541 | Additional Members: 13 | Rows returned: 121 2 Next >> 
SPE01505498 0.35
Prest888 0.35
Prest536 0.32258064516129
LOPAC 01145 0.32258064516129
SPE01503934 0.32258064516129
LOPAC 01148 0.3

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