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

Compound InformationSONAR Target prediction
Name:

VINDOLINE

Unique Identifier:SPE01505004
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C25H32N2O6
Molecular Weight:424.277 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:CCC12C=CCN3CCC4(C(N(C)c5cc(OC)ccc54)C(O)(C1OC(C)=O)C(=O)OC)C32
Class:alkaloid
Source:Vinca rosea, V pusilla
Reference:JACS 54:1058 (1962); Naturwissenschaften 51:637 (1964); 52:132 (1965); Japan J Can
Res 77:197 (1986); J Curr Pharn Des 7:1181 (2001)
Therapeutics:CNS stimulant/depressant; antihyperglycaemic

Found: 104 nonactive as graph: single | with analogs [1] << Back 101 102 103 104
Species: 4932
Condition: TOR1
Replicates: 2
Raw OD Value: r im 0.8813±0.00735391
Normalized OD Score: sc h 0.9086±0.000941785
Z-Score: -1.4609±0.128705
p-Value: 0.145711
Z-Factor: 0.177263
Fitness Defect: 1.9261
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum_ED
Plate Number and Position:20|B8
Drug Concentration:50.00 nM
OD Absorbance:595 nm
Robot Temperature:30.00 Celcius
Date:2012-09-18 YYYY-MM-DD
Plate CH Control (+):0.004125±0.00199
Plate DMSO Control (-):0.995825±0.02520
Plate Z-Factor:0.9107
png
ps
pdf

DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 15220 | Additional Members: 6 | Rows returned: 2
LOPAC 01287 0
SPE01500611 0

Service provided by the Mike Tyers Laboratory