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

Compound InformationSONAR Target prediction
Name:

DAUNORUBICIN

Unique Identifier:SPE01500223
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C27H29NO10
Molecular Weight:498.29 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:COc1cccc2c(=O)c3c(O)c4CC(O)(CC(OC5CC(N)C(O)C(C)O5)c4c(O)c3c(=O)c12)C(C
)=O
Class:quinone
Source:Streptomyces peucetius; FI-6339, NDC-0082-4155, RP-13057
Therapeutics:antineoplastic

Found: 16 active | as graph: single | with analogs << Back 11 12 13 14 15 16 Next >> 
Species: 4932
Condition: SAC3
Replicates: 2
Raw OD Value: r im 0.3919±0.0493561
Normalized OD Score: sc h 0.8364±0.0444824
Z-Score: -4.7570±1.45263
p-Value: 0.0000958072
Z-Factor: -0.360575
Fitness Defect: 9.2532
Bioactivity Statement: Active
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:9|A2
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.10 Celcius
Date:2008-05-16 YYYY-MM-DD
Plate CH Control (+):0.04045±0.00063
Plate DMSO Control (-):0.467275±0.01469
Plate Z-Factor:0.8674
png
ps
pdf

DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 5481 | Additional Members: 8 | Rows returned: 5
LOPAC 00975 0.36734693877551
Prest791 0.172043010752688
SPE01505483 0
SPE01505708 0
Prest188 0

Service provided by the Mike Tyers Laboratory