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Compound InformationSONAR Target prediction
Name:

LATHOSTEROL

Unique Identifier:SPE01500843
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:341.296 g/mol
X log p:3.679  (online calculus)
Lipinksi Failures0
TPSA0
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:1
Rotatable Bond Count:5
Canonical Smiles:CC(C)CCCC(C)C1CCC2C3=CCC4CC(O)CCC4(C)C3CCC12C
Class:sterol
Source:Austeria rubens
Reference:J Biol Chem 248: 6697 (1973)
Generic_name:LANOSTEROL
Chemical_iupac_name:LANOSTEROL
Drug_type:Experimental
Kegg_compound_id:C01724
Drugbank_id:EXPT02002
Logp:7.63
Cas_registry_number:79-63-0
Drug_category:Lanosterol Synthase inhibitor
Organisms_affected:-1

Found: 2 active | as graph: single | with analogs 1 2 Next >> 
Species: 4932
Condition: HXK2
Replicates: 2
Raw OD Value: r im 0.6940±0.00869741
Normalized OD Score: sc h 0.9089±0.012243
Z-Score: -4.0672±0.628939
p-Value: 0.000149113
Z-Factor: -0.129654
Fitness Defect: 8.8108
Bioactivity Statement: Active
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:22|A3
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:23.20 Celcius
Date:2008-03-05 YYYY-MM-DD
Plate CH Control (+):0.041374999999999995±0.00110
Plate DMSO Control (-):0.739075±0.01758
Plate Z-Factor:0.9097
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DBLink | Rows returned: 277[1] << Back 41 42 43 44 45 46 47
16061334 (3S,5S,10S,13R,17R)-10,13-dimethyl-17-[(2R)-6-methylhept-5-en-2-yl]-2,3,4,5,6,9,11,12,14,15,16,17-dodeca
hydro-1H-cyclopenta[a]phenanthren-3-ol

internal high similarity DBLink | Rows returned: 111 2 Next >> 
SPE01504073 0.9167
SPE01504051 0.9189
SPE01500847 0.9189
SPE00107022 0.9189
SPE00300055 0.9444
NRB 03722 0.9706

active | Cluster 14237 | Additional Members: 2 | Rows returned: 0
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