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Compound InformationSONAR Target prediction
Name:

PROPIOMAZINE MALEATE

Unique Identifier:SPE01500512
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C24H28N2O5S
Molecular Weight:428.333 g/mol
X log p:15.486  (online calculus)
Lipinksi Failures1
TPSA48.85
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:5
Canonical Smiles:CCC(=O)c1ccc2Sc3ccccc3N(CC(C)N(C)C)c2c1.OC(=O)C=CC(O)=O
Therapeutics:sedative, hypnotic

Found: 101 nonactive as graph: single | with analogs [1] << Back 81 82 83 84 85 86 87 88 89 90  Next >> [101]
Species: 4932
Condition: SHM2
Replicates: 2
Raw OD Value: r im 0.7882±0.00388909
Normalized OD Score: sc h 0.9852±0.0000959416
Z-Score: -0.5470±0.0234889
p-Value: 0.584444
Z-Factor: -1.92667
Fitness Defect: 0.5371
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:16|D3
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.60 Celcius
Date:2006-04-08 YYYY-MM-DD
Plate CH Control (+):0.038474999999999995±0.00543
Plate DMSO Control (-):0.783525±0.01187
Plate Z-Factor:0.9467
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DBLink | Rows returned: 1
5702109 but-2-enedioic acid; 1-[10-(2-dimethylaminopropyl)phenothiazin-2-yl]propan-1-one

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 7451 | Additional Members: 8 | Rows returned: 6
SPE01504095 0.388888888888889
Prest195 0.266666666666667
SPE01500293 0.266666666666667
SPE01500510 0
Prest1176 0
LOPAC 00147 0

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