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

Compound InformationSONAR Target prediction
Name:

NISOLDIPINE

Unique Identifier:SPE01505390
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C20H24N2O6
Molecular Weight:364.224 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:[O-][N+](=O)c1ccccc1C1C(=C(C)NC(C)=C1C(=O)OCC(C)C)C(=O)OC
Source:synthetic; bayk-5552
Therapeutics:vasodilator (coronary)

Found: 93 active | as graph: single | with analogs [1] << Back 91 92 93 Next >> [93]
Species: 4932
Condition: pdr_yCG196
Replicates: 2
Raw OD Value: r im 0.0925±0.00353553
Normalized OD Score: sc h 0.1267±0.00189852
Z-Score: -29.2077±0.158175
p-Value: 0
Z-Factor: 0.927259
Fitness Defect: INF
Bioactivity Statement: Toxic
Experimental Conditions
Library:Spectrum_ED
Plate Number and Position:10|A5
Drug Concentration:50.00 nM
OD Absorbance:595 nm
Robot Temperature:30.00 Celcius
Date:2010-08-10 YYYY-MM-DD
Plate CH Control (+):0.09325±0.00804
Plate DMSO Control (-):0.9219999999999999±0.01780
Plate Z-Factor:0.8791
png
ps
pdf

DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 5071 | Additional Members: 12 | Rows returned: 3
SPE01500431 0
LOPAC 00213 0
Prest357 0

Service provided by the Mike Tyers Laboratory