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Compound InformationSONAR Target prediction
Name:

SOLASODINE

Unique Identifier:SPE00100537
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:370.294 g/mol
X log p:1.721  (online calculus)
Lipinksi Failures0
TPSA9.23
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:0
Canonical Smiles:CC1CCC2(NC1)OC1CC3C4CC=C5CC(O)CCC5(C)C4CCC3(C)C1C2C
Class:alkaloid
Source:numerous Solanum spp
Reference:J Am Chem Soc 76: 4245 (1954); Alkaloids 19: 81 (1981)
Therapeutics:antineoplastic, antiinflammatory

Found: 193 active | as graph: single | with analogs [1] << Back 121 122 123 124 125 126 127 128 129 130  Next >> [193]
Species: 4932
Condition: GBP2
Replicates: 2
Raw OD Value: r im 0.0488±0.000353553
Normalized OD Score: sc h 0.0674±0.0005598
Z-Score: -40.8319±0.911025
p-Value: 0
Z-Factor: 0.89591
Fitness Defect: INF
Bioactivity Statement: Toxic
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:11|G7
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.00 Celcius
Date:2008-03-26 YYYY-MM-DD
Plate CH Control (+):0.040625±0.00116
Plate DMSO Control (-):0.687475±0.02178
Plate Z-Factor:0.9109
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DBLink | Rows returned: 291 2 3 4 5 Next >> 
5250 n/a
31342 n/a
442985 n/a
581905 n/a
638272 -1
2771513 n/a

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 10789 | Additional Members: 6 | Rows returned: 4
SPE01504607 0.584158415841584
LAT005E11 0.340909090909091
SPE00100318 0.340909090909091
Prest1042 0

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