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Compound InformationSONAR Target prediction
Name:

SELAMECTIN

Unique Identifier:SPE01503720
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:676.454 g/mol
X log p:8.983  (online calculus)
Lipinksi Failures1
TPSA81.68
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:10
Rotatable Bond Count:4
Canonical Smiles:COC1CC(OC(C)C1O)OC1C(C)C=CC=C2COC3CC(C)=CC(C(=O)OC4CC(CC=C1C)OC1(CCC(C
)C(O1)C1CCCCC1)C4)C32O
Source:semisynthetic
Therapeutics:antiparasitic, antimite

Found: 26 active | as graph: single | with analogs [1] << Back 21 22 23 24 25 26 Next >> [26]
Species: 4932
Condition: SSE1
Replicates: 2
Raw OD Value: r im 0.3159±0.0374767
Normalized OD Score: sc h 0.6197±0.0466659
Z-Score: -10.2000±0.634493
p-Value: 9.0987e-23
Z-Factor: 0.163749
Fitness Defect: 50.7513
Bioactivity Statement: Active
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:20|D8
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.00 Celcius
Date:2008-05-01 YYYY-MM-DD
Plate CH Control (+):0.04125±0.00064
Plate DMSO Control (-):0.46862499999999996±0.02947
Plate Z-Factor:0.6839
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DBLink | Rows returned: 3
5194
5702263
6708470

internal high similarity DBLink | Rows returned: 2
LOPAC 00986 0.9671
SPE01502260 0.9671

active | Cluster 12611 | Additional Members: 6 | Rows returned: 2
SPE01502260 0.1875
LOPAC 00986 0

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