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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: 29 nonactive | as graph: single | with analogs [1] << Back 21 22 23 24 25 26 27 28 29 Next >> [29]
Species: 4932
Condition: MKK1
Replicates: 2
Raw OD Value: r im 0.8155±0.00636396
Normalized OD Score: sc h 1.0292±0.0027647
Z-Score: 0.8321±0.0326743
p-Value: 0.405476
Z-Factor: -2.39496
Fitness Defect: 0.9027
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum_ED
Plate Number and Position:14|G9
Drug Concentration:50.00 nM
OD Absorbance:595 nm
Robot Temperature:30.00 Celcius
Date:2010-08-10 YYYY-MM-DD
Plate CH Control (+):0.10275±0.00968
Plate DMSO Control (-):0.9592499999999999±0.02497
Plate Z-Factor:0.8993
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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

active | Cluster 10789 | Additional Members: 6 | Rows returned: 2
SPE01504607 0.584158415841584
Prest1042 0

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