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

Compound InformationSONAR Target prediction
Name:

4-Androsten-4-ol-3,17-dione

Unique Identifier:LOPAC 00661
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C19H26O3
Molecular Weight:276.202 g/mol
X log p:-0.732  (online calculus)
Lipinksi Failures0
TPSA34.14
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:0
Canonical Smiles:CC12CCC3C(CCC4=C(O)C(=O)CCC34C)C1CCC2=O
Class:Hormone
Action:Inhibitor
Selectivity:Aromatase

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: KRE1
Replicates: 2
Raw OD Value: r im 0.6721±0.0338704
Normalized OD Score: sc h 1.0205±0.0428861
Z-Score: 0.9076±1.86351
p-Value: 0.353882
Z-Factor: -7.67903
Fitness Defect: 1.0388
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:1|G9
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.90 Celcius
Date:2005-11-22 YYYY-MM-DD
Plate CH Control (+):0.0389±0.00106
Plate DMSO Control (-):0.6550750000000001±0.01492
Plate Z-Factor:0.9215
png
ps
pdf

DBLink | Rows returned: 16<< Back 1 2 3 Next >> 
160615 (8R,9S,10R,13S,14S,17S)-4,17-dihydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopent
a[a]phenanthren-3-one
164714 (8S,9S,10R,13R,14S,17S)-17-acetyl-4-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocycl
openta[a]phenanthren-3-one
253543 2-hydroxy-4,4,10,13,14-pentamethyl-17-(6-methylheptan-2-yl)-5,6,7,8,9,11,12,15,16,17-decahydrocyclopenta
[a]phenanthren-3-one
351707 4,17-dihydroxy-13,17-dimethyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one
518960 4,17-dihydroxy-10,13,17-trimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
573196 9-hydroxyspiro[4.5]dec-8-en-10-one

internal high similarity DBLink | Rows returned: 2
SPE01701060 0.9020
LOPAC 00951 0.9184

nonactive | Cluster 17181 | Additional Members: 4 | Rows returned: 1
SPE01504116 0

Service provided by the Mike Tyers Laboratory