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Compound InformationSONAR Target prediction
Name:

VINBLASTINE SULFATE

Unique Identifier:SPE01500611
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C46H60N4O13S
Molecular Weight:850.593 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)C2C(O)(C(
OC(C)=O)C4(CC)C=CCN5CCC23C54)C(=O)OC)C1.OS(O)(=O)=O
Class:alkaloid
Source:Vinca rosea
Therapeutics:antineoplastic, spindle poison

Found: 104 nonactive as graph: single | with analogs [1] << Back 51 52 53 54 55 56 57 58 59 60  Next >> [104]
Species: 4932
Condition: MRC1
Replicates: 2
Raw OD Value: r im 0.6979±0.0259508
Normalized OD Score: sc h 1.0191±0.0263246
Z-Score: 0.9771±1.35769
p-Value: 0.519564
Z-Factor: -7.0054
Fitness Defect: 0.6548
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:17|A3
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:23.00 Celcius
Date:2008-01-15 YYYY-MM-DD
Plate CH Control (+):0.04435±0.00081
Plate DMSO Control (-):0.675175±0.02453
Plate Z-Factor:0.9428
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 15220 | Additional Members: 6 | Rows returned: 2
SPE01505004 0.409090909090909
LOPAC 01287 0

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