Home | Screening data | Screen comparisons | Search for compounds | Structure search

Compound InformationSONAR Target prediction
Name:

Chloroethylclonidine dihydrochloride

Unique Identifier:LOPAC 00734
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C13Cl5H19N4
Molecular Weight:389.43 g/mol
X log p:5.996  (online calculus)
Lipinksi Failures1
TPSA15.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:5
Canonical Smiles:Cl.Cl.CN(CCCl)Cc1cc(Cl)c(N=C2NCCN2)c(Cl)c1
Class:Adrenoceptor
Action:Antagonist
Selectivity:alpha1B

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: DEP1
Replicates: 2
Raw OD Value: r im 0.6183±0.00636396
Normalized OD Score: sc h 0.9999±0.00736037
Z-Score: 0.0024±0.302145
p-Value: 0.830822
Z-Factor: -8.45871
Fitness Defect: 0.1853
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:3|D6
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.90 Celcius
Date:2005-11-16 YYYY-MM-DD
Plate CH Control (+):0.03945±0.00171
Plate DMSO Control (-):0.6265750000000001±0.02088
Plate Z-Factor:0.8647
png
ps
pdf

DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 157 | Additional Members: 6 | Rows returned: 0
Service provided by the Mike Tyers Laboratory