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

Compound InformationSONAR Target prediction
Name:

MITOXANTHRONE HYDROCHLORIDE

Unique Identifier:SPE01503278
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:487.164 g/mol
X log p:6.694  (online calculus)
Lipinksi Failures2
TPSA34.14
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:10
Rotatable Bond Count:12
Canonical Smiles:Cl.Cl.OCCNCCNc1ccc(NCCNCCO)c2c(=O)c3c(O)ccc(O)c3c(=O)c12
Source:semisynthetic
Therapeutics:antineoplastic

Found: 144 active | as graph: single | with analogs [1] << Back 141 142 143 144 Next >> [144]
Species: 4932
Condition: TOP1
Replicates: 2
Raw OD Value: r im 0.1542±0.00289914
Normalized OD Score: sc h 0.4237±0.00179429
Z-Score: -5.0151±0.329587
p-Value: 0.000000944496
Z-Factor: 0.771714
Fitness Defect: 13.8726
Bioactivity Statement: Toxic
Experimental Conditions
Library:Spectrum
Plate Number and Position:13|G4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.80 Celcius
Date:2006-04-25 YYYY-MM-DD
Plate CH Control (+):0.039825±0.00139
Plate DMSO Control (-):0.372575±0.01569
Plate Z-Factor:0.8504
png
ps
pdf

DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 14085 | Additional Members: 3 | Rows returned: 1
LOPAC 01057 0

Service provided by the Mike Tyers Laboratory