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Compound InformationSONAR Target prediction
Name:

Veratrine Sulfate

Unique Identifier:LAT001C07
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C32H51NO13S
Molecular Weight:639.415 g/mol
X log p:-0.855000000000001  (online calculus)
Lipinksi Failures0
TPSA38.77
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:10
Rotatable Bond Count:3
Canonical Smiles:CC=C(C)C(=O)OC1CCC2(C)C3CCC4C5(O)CC(O)C6(O)C(CN7CC(C)CCC7C6(C)O)C5(O)C
C42OC13O.OS(O)(=O)=O

Found: 5 nonactive as graph: single | with analogs << Back 1 2 3 4 5
Species: 4932
Condition: wt24h
Replicates: 2
Raw OD Value: r im 0.8319±0.00869741
Normalized OD Score: sc h 1.0242±0.0117785
Z-Score: 1.3314±0.549815
p-Value: 0.215634
Z-Factor: -2.18028
Fitness Defect: 1.5342
Bioactivity Statement: Nonactive
Experimental Conditions
Library:LATCA
Plate Number and Position:1|C7
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.50 Celcius
Date:2007-02-28 YYYY-MM-DD
Plate CH Control (+):0.039599999999999996±0.00150
Plate DMSO Control (-):0.79905±0.01174
Plate Z-Factor:0.9475
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DBLink | Rows returned: 2
5351532
5702002

internal high similarity DBLink | Rows returned: 1
SPE00310300 1.0000

nonactive | Cluster 14579 | Additional Members: 6 | Rows returned: 3
SPE01503662 0.224489795918367
SPE01503815 0
SPE00310300 0

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