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Compound InformationSONAR Target prediction
Name:

Vincristine sulfate

Unique Identifier:LOPAC 01290
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C46H58N4O14S
Molecular Weight:865.585 g/mol
X log p:15.514  (online calculus)
Lipinksi Failures3
TPSA114.92
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:14
Rotatable Bond Count:11
Canonical Smiles:CCC1(O)CC2CN(CCc3c(nc4ccccc43)C(C2)(C(=O)OC)c2cc3c(cc2OC)N(C=O)C2C(O)(
C(OC(C)=O)C4(CC)C=CCN5CCC23C54)C(=O)OC)C1.OS(O)(=O)=O
Class:Cytoskeleton and ECM
Action:Inhibitor
Selectivity:Tubulin

Found: 24 nonactive as graph: single | with analogs [1] << Back 1 2 3 4 5 6 7 8 9 10  Next >> [24]
Species: 4932
Condition: GIM3
Replicates: 4
Raw OD Value: r im 0.5520±0.157727
Normalized OD Score: sc h 1.0119±0.046063
Z-Score: 0.4580±1.03087
p-Value: 0.356878
Z-Factor: -4.40078
Fitness Defect: 1.0304
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:16|A9
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.70 Celcius
Date:2005-04-08 YYYY-MM-DD
Plate CH Control (+):0.0463±0.00190
Plate DMSO Control (-):0.6698625000000001±0.13841
Plate Z-Factor:0.0496
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 1
LOPAC 01287 0.9613

active | Cluster 9378 | Additional Members: 3 | Rows returned: 0
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