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Compound InformationSONAR Target prediction
Name:

Cantharidin

Unique Identifier:LAT003F08
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C10H12O4
Molecular Weight:184.105 g/mol
X log p:-1.539  (online calculus)
Lipinksi Failures0
TPSA52.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:0
Canonical Smiles:CC12C3CCC(O3)C1(C)C(=O)OC2=O

Found: 5 nonactive as graph: single | with analogs << Back 1 2 3 4 5 Next >> 
Species: 4932
Condition: pdr22h
Replicates: 2
Raw OD Value: r im 0.6883±0.00650538
Normalized OD Score: sc h 1.0262±0.0370522
Z-Score: 1.2126±1.44524
p-Value: 0.437122
Z-Factor: -5.64023
Fitness Defect: 0.8275
Bioactivity Statement: Nonactive
Experimental Conditions
Library:LATCA
Plate Number and Position:3|F8
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.90 Celcius
Date:2007-03-08 YYYY-MM-DD
Plate CH Control (+):0.040175±0.00260
Plate DMSO Control (-):0.652475±0.01329
Plate Z-Factor:0.9465
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DBLink | Rows returned: 28<< Back 1 2 3 4 5 Next >> 
305445 n/a
3032278 n/a
3038026 n/a
3503030 3-(oxolan-2-yl)oxolane-2,5-dione
3565036 n/a
4231679 n/a

internal high similarity DBLink | Rows returned: 6
BIOMOL 62 1.0000
LOPAC 00793 1.0000
LOPAC 01099 1.0000
Prest1130 1.0000
SPE01500814 1.0000
SPE01504153 1.0000

active | Cluster 4981 | Additional Members: 6 | Rows returned: 2
LOPAC 00793 0
SPE01500814 0

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