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Compound InformationSONAR Target prediction
Name:

LITHOCHOL-11-ENIC ACID

Unique Identifier:SPE01500848
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C24H38O3
Molecular Weight:337.263 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:CC(CCC(O)=O)C1CCC2C3CCC4CC(O)CCC4(C)C3C=CC12C
Source:Curvularia spp.
Reference:J Chem Soc 1974: 1797

Found: 66 nonactive | as graph: single | with analogs [1] << Back 41 42 43 44 45 46 47 48 49 50  Next >> [66]
Species: 4932
Condition: RPN1
Replicates: 2
Raw OD Value: r im 0.6534±0.00360624
Normalized OD Score: sc h 0.9957±0.000694013
Z-Score: -0.2212±0.0343424
p-Value: 0.82499
Z-Factor: -215.59
Fitness Defect: 0.1924
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:22|A4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.40 Celcius
Date:2008-05-28 YYYY-MM-DD
Plate CH Control (+):0.040575±0.00093
Plate DMSO Control (-):0.641925±0.01943
Plate Z-Factor:0.8959
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 15990 | Additional Members: 2 | Rows returned: 1
SPE01500856 0

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