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Compound InformationSONAR Target prediction
Name:

O-Methylserotonin hydrochloride

Unique Identifier:LOPAC 01058
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C11ClH15N2O
Molecular Weight:211.583 g/mol
X log p:8.17  (online calculus)
Lipinksi Failures1
TPSA9.23
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:3
Canonical Smiles:Cl.COc1ccc2ncc(CCN)c2c1
Class:Serotonin
Action:Agonist

Found: 24 nonactive as graph: single | with analogs [1] << Back 11 12 13 14 15 16 17 18 19 20  Next >> [24]
Species: 4932
Condition: SAP30
Replicates: 2
Raw OD Value: r im 0.7960±0.0189505
Normalized OD Score: sc h 0.9847±0.00896522
Z-Score: -1.2933±0.689394
p-Value: 0.24764
Z-Factor: -2.84992
Fitness Defect: 1.3958
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:10|G10
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.20 Celcius
Date:2005-11-18 YYYY-MM-DD
Plate CH Control (+):0.03945±0.00129
Plate DMSO Control (-):0.79005±0.01014
Plate Z-Factor:0.9504
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 2
AC 11641 0.9506
SPE02300296 1.0000

nonactive | Cluster 15603 | Additional Members: 14 | Rows returned: 5
LOPAC 00976 0.442622950819672
SPE02300296 0.358490566037736
Prest312 0
SPE01500690 0
LOPAC 00520 0

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