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Compound InformationSONAR Target prediction
Name:

Artemisinin

Unique Identifier:Prest818
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C15H22O5
Molecular Weight:263.181 g/mol
X log p:-0.183  (online calculus)
Lipinksi Failures0
TPSA53.99
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:5
Rotatable Bond Count:0
Canonical Smiles:CC1CCC2C(C)C(=O)OC3OC4(C)CCC1C32OO4

Found: 3 nonactive as graph: single | with analogs 2 3 Next >> 
Species: 9606
Condition: TMPPre001
Replicates: 2
Raw OD Value: r im 1998.0000±0
Normalized OD Score: sc h 1.0048±0
Z-Score: 0.1071±0
p-Value: 0.914718
Z-Factor: -6.22135
Fitness Defect: 0.0891
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Prestwick
Plate Number and Position:7|B9
Drug Concentration:50.00 nM
OD Absorbance:0 nm
Robot Temperature:24.10 Celcius
Date:2006-10-10 YYYY-MM-DD
Plate CH Control (+):951.5±923.27222
Plate DMSO Control (-):2006±543.99595
Plate Z-Factor:-4.4324
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DBLink | Rows returned: 152 3 Next >> 
2240
68827
452191
536982
537065
537182

internal high similarity DBLink | Rows returned: 0

active | Cluster 4356 | Additional Members: 5 | Rows returned: 2
LAT001H11 0
SPE01503042 0

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