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Compound InformationSONAR Target prediction
Name:

VINCRISTINE SULFATE

Unique Identifier:SPE01505672
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C46H58N4O14S
Molecular Weight:866.593 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
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:alkaloid
Source:Vinca rosea; 37231, NSC-67574
Reference:Int Pharmacodyn Ther 157:299 (1965)
Therapeutics:antineoplastic

Found: 104 nonactive as graph: single | with analogs [1] << Back 81 82 83 84 85 86 87 88 89 90  Next >> [104]
Species: 4932
Condition: SSE1
Replicates: 2
Raw OD Value: r im 0.4138±0.00551543
Normalized OD Score: sc h 0.9531±0.0255959
Z-Score: -1.2899±0.77034
p-Value: 0.261362
Z-Factor: -2.64289
Fitness Defect: 1.3418
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:9|A11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:23.60 Celcius
Date:2008-05-01 YYYY-MM-DD
Plate CH Control (+):0.041125±0.00127
Plate DMSO Control (-):0.41065±0.02097
Plate Z-Factor:0.8202
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

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

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