Home | Screening data | Screen comparisons | Search for compounds | Structure search

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 61 62 63 64 65 66 67 68 69 70  Next >> [104]
Species: 4932
Condition: POM152
Replicates: 2
Raw OD Value: r im 0.6940±0.00558614
Normalized OD Score: sc h 0.9665±0.00720904
Z-Score: -1.7683±0.367467
p-Value: 0.086984
Z-Factor: -1.25618
Fitness Defect: 2.442
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:17|A3
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.60 Celcius
Date:2008-03-15 YYYY-MM-DD
Plate CH Control (+):0.041175±0.00097
Plate DMSO Control (-):0.6990749999999999±0.01167
Plate Z-Factor:0.9536
png
ps
pdf

DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 15220 | Additional Members: 6 | Rows returned: 0
Service provided by the Mike Tyers Laboratory