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Compound InformationSONAR Target prediction
Name:

Norcantharidin

Unique Identifier:LAT004A04
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C8H8O4
Molecular Weight:160.083 g/mol
X log p:-0.299  (online calculus)
Lipinksi Failures0
TPSA52.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:0
Canonical Smiles:O=C1OC(=O)C2C3CCC(O3)C21

Found: 5 nonactive as graph: single | with analogs << Back 1 2 3 4 5 Next >> 
Species: 4932
Condition: wt18h
Replicates: 2
Raw OD Value: r im 0.8318±0.00325269
Normalized OD Score: sc h 0.9932±0.00200866
Z-Score: -0.1358±0.109635
p-Value: 0.89231
Z-Factor: -8.3329
Fitness Defect: 0.1139
Bioactivity Statement: Nonactive
Experimental Conditions
Library:LATCA
Plate Number and Position:4|A4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.80 Celcius
Date:2007-02-28 YYYY-MM-DD
Plate CH Control (+):0.040675±0.00207
Plate DMSO Control (-):0.8063999999999999±0.27232
Plate Z-Factor:-0.0698
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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 564 | Additional Members: 4 | Rows returned: 1
SPE01504153 0

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