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Compound InformationSONAR Target prediction
Name:

N,N-DIMETHYLAMILORIDE

Unique Identifier:SPE01503999
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C8Cl2H13N7O
Molecular Weight:281.038 g/mol
X log p:-1.523  (online calculus)
Lipinksi Failures0
TPSA45.03
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:8
Rotatable Bond Count:4
Canonical Smiles:Cl.CN(C)c1nc(N)c(nc1Cl)C(=O)NC(N)=N
Reference:J Pharmacol Exp Therap 256: 1094 (1991)
Therapeutics:inhibitor of Na+/H+ antiport

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: SMI1
Replicates: 2
Raw OD Value: r im 0.6649±0.0149907
Normalized OD Score: sc h 1.0019±0.00790975
Z-Score: 0.0465±0.17014
p-Value: 0.904342
Z-Factor: -143.668
Fitness Defect: 0.1005
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:22|B4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.10 Celcius
Date:2005-12-20 YYYY-MM-DD
Plate CH Control (+):0.0392±0.00223
Plate DMSO Control (-):0.635525±0.01853
Plate Z-Factor:0.8490
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 2
LOPAC 00165 0.9016
SPE01500112 0.9016

active | Cluster 4060 | Additional Members: 8 | Rows returned: 2
SPE01504215 0.462962962962963
SPE01500112 0

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