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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 61 62 63 64 65 66 67 68 69 70  Next >> [101]
Species: 4932
Condition: PMR1
Replicates: 2
Raw OD Value: r im 0.6011±0.00247487
Normalized OD Score: sc h 1.0420±0.013675
Z-Score: 1.9561±0.680481
p-Value: 0.0775164
Z-Factor: -2.52166
Fitness Defect: 2.5573
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:23|D6
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.60 Celcius
Date:2008-07-04 YYYY-MM-DD
Plate CH Control (+):0.041825±0.00055
Plate DMSO Control (-):0.557225±0.01918
Plate Z-Factor:0.8744
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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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