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Compound InformationSONAR Target prediction
Name:

R(-)-Apocodeine hydrochloride

Unique Identifier:LOPAC 00257
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C18ClH20NO2
Molecular Weight:298.659 g/mol
X log p:10.858  (online calculus)
Lipinksi Failures1
TPSA12.47
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:1
Canonical Smiles:Cl.COc1ccc2CC3N(C)CCc4cccc(c34)c2c1O
Class:Dopamine
Action:Agonist

Found: 24 nonactive as graph: single | with analogs 1 2 3 4 5 6 7 8 9 10  Next >> [24]
Species: 4932
Condition: BY4741
Replicates: 8
Raw OD Value: r im 0.8137±0.100121
Normalized OD Score: sc h 1.0242±0.0155382
Z-Score: 0.9553±0.538408
p-Value: 0.341384
Z-Factor: -3.47412
Fitness Defect: 1.0747
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:6|C6
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.70 Celcius
Date:2005-04-07 YYYY-MM-DD
Plate CH Control (+):0.046787499999999996±0.00101
Plate DMSO Control (-):0.7538062500000003±0.03766
Plate Z-Factor:0.8896
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DBLink | Rows returned: 4
5021
12545
22872
6093246

internal high similarity DBLink | Rows returned: 4
SPE01500860 0.9040
LOPAC 00266 0.9187
SPE01500129 0.9313
LOPAC 01342 0.9363

active | Cluster 14460 | Additional Members: 5 | Rows returned: 3
LOPAC 00270 0.369230769230769
SPE01500129 0
LOPAC 01342 0

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