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Compound InformationSONAR Target prediction
Name:

TESTOSTERONE PROPIONATE

Unique Identifier:SPE00300034
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:312.234 g/mol
X log p:1.957  (online calculus)
Lipinksi Failures0
TPSA43.37
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:3
Canonical Smiles:CCC(=O)OC1CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C
Source:semisynthetic
Therapeutics:androgen, antineoplastic

Found: 235 active | as graph: single | with analogs [1] << Back 41 42 43 44 45 46 47 48 49 50  Next >> [235]
Species: 4932
Condition: SPE01502223
Replicates: 2
Raw OD Value: r im 0.4837±0.0135764
Normalized OD Score: sc h 0.8172±0.0700779
Z-Score: -5.5975±1.43247
p-Value: 0.00000227384
Z-Factor: -0.529482
Fitness Defect: 12.994
Bioactivity Statement: Active
Experimental Conditions
Library:SpectrumTMP
Plate Number and Position:1|E10
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:22.60 Celcius
Date:2006-11-29 YYYY-MM-DD
Plate CH Control (+):0.0409±0.00261
Plate DMSO Control (-):0.599375±0.01340
Plate Z-Factor:0.9141
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DBLink | Rows returned: 89<< Back 11 12 13 14 15
7099830 [(8R,9R,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phen
anthren-17-yl] hexanoate
7099831 [(8R,9R,10R,13S,14R,17S)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phen
anthren-17-yl] hexanoate
7099832 [(8R,9S,10R,13S,14R,17S)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phen
anthren-17-yl] hexanoate
15942790 [(8R,9S,10R,13S,14S,16S,17S)-16-ethyl-13-methyl-3-oxo-2,6,7,8,9,10,11,12,14,15,16,17-dodecahydro-1H-cycl
openta[a]phenanthren-17-yl] hexanoate
16048663 [(8S,9S,10R,14S,17S)-10-methyl-3-oxo-2,6,7,8,9,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanth
ren-17-yl] undecanoate

internal high similarity DBLink | Rows returned: 5
SPE00310003 0.9194
SPE00100580 0.9242
SPE00307045 0.9242
NRB 03698 0.9385
NRB 03689 1.0000

active | Cluster 2094 | Additional Members: 20 | Rows returned: 6
SPE00307023 0.348484848484849
SPE00300029 0.285714285714286
SPE01500508 0
LAT002C06 0
LAT005F10 0
LOPAC 01120 0

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