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Compound InformationSONAR Target prediction
Name:

GARLICIN

Unique Identifier:SPE01505174
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C6H10S2
Molecular Weight:136.196 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:C=CCSSCC=C
Class:alkane
Source:Allium spp, Descurainia sophia
Reference:Pharmazie 20:441 (1965); J Org Chem 40:1567 (1975); Food Chem Toxicol 26:297 (1988);
Cancer Res 35:3493 (1993); Bioxhim Biophys Acta 1315:15 (1996)
Therapeutics:antineoplastic, antibacterial, apoptosis inducer, insecticide

Found: 101 nonactive | as graph: single | with analogs [1] << Back 11 12 13 14 15 16 17 18 19 20  Next >> [101]
Species: 4932
Condition: ARC18
Replicates: 2
Raw OD Value: r im 0.7136±0.0101116
Normalized OD Score: sc h 1.0374±0.00845919
Z-Score: 1.6853±0.411027
p-Value: 0.105644
Z-Factor: -1.24421
Fitness Defect: 2.2477
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:23|D6
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.80 Celcius
Date:2008-02-28 YYYY-MM-DD
Plate CH Control (+):0.041575±0.00105
Plate DMSO Control (-):0.66995±0.01608
Plate Z-Factor:0.9357
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 11 | Additional Members: 3 | Rows returned: 1
SPE01505014 0

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