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Compound InformationSONAR Target prediction
Name:

TRIAMCINOLONE ACETONIDE

Unique Identifier:SPE01500587
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:403.252 g/mol
X log p:3.815  (online calculus)
Lipinksi Failures0
TPSA52.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:6
Rotatable Bond Count:2
Canonical Smiles:CC1(C)OC2CC3C4CCC5=CC(=O)C=CC5(C)C4(F)C(O)CC3(C)C2(O1)C(=O)CO
Source:semisynthetic
Therapeutics:antiinflammatory

Found: 205 nonactive as graph: single | with analogs [1] << Back 31 32 33 34 35 36 37 38 39 40  Next >> [205]
Species: 4932
Condition: ELF1
Replicates: 2
Raw OD Value: r im 0.6118±0.00438406
Normalized OD Score: sc h 0.9675±0.0110628
Z-Score: -1.3364±0.462053
p-Value: 0.20446
Z-Factor: -5.45031
Fitness Defect: 1.5874
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:7|E6
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.10 Celcius
Date:2008-07-11 YYYY-MM-DD
Plate CH Control (+):0.041150000000000006±0.00089
Plate DMSO Control (-):0.631525±0.04307
Plate Z-Factor:0.7900
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DBLink | Rows returned: 91 2 Next >> 
6436
451145
633097
3037685
5702126
6557546

internal high similarity DBLink | Rows returned: 3
SPE01501187 0.9076
SPE01503816 0.9194
SPE01500302 0.9500

active | Cluster 2095 | Additional Members: 14 | Rows returned: 0
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