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

Compound InformationSONAR Target prediction
Name:

3beta-HYDROXY-23,24-BISNORCHOL-5-ENIC ACID

Unique Identifier:SPE00270043
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C22H34O3
Molecular Weight:312.234 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:CC(C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C)C(O)=O
Source:semisynthetic

Found: 6 active | as graph: single | with analogs << Back 1 2 3 4 5 6 Next >> 
Species: 4932
Condition: SSE1
Replicates: 2
Raw OD Value: r im 0.5317±0.0138593
Normalized OD Score: sc h 1.2592±0.00930955
Z-Score: 6.9576±0.162861
p-Value: 0.00000000000465274
Z-Factor: 0.227413
Fitness Defect: 26.0936
Bioactivity Statement: Active
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:11|D11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:23.70 Celcius
Date:2008-05-01 YYYY-MM-DD
Plate CH Control (+):0.040825±0.00041
Plate DMSO Control (-):0.38722499999999993±0.02109
Plate Z-Factor:0.8178
png
ps
pdf

DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 17506 | Additional Members: 20 | Rows returned: 91 2 Next >> 
SPE00270090 0.529411764705882
SPE01500854 0.416666666666667
SPE00270083 0.402597402597403
SPE01500849 0.354430379746835
SPE01504051 0.345679012345679
Prest11 0.226666666666667

Service provided by the Mike Tyers Laboratory