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Compound InformationSONAR Target prediction
Name:

ASCORBIC ACID

Unique Identifier:SPE01502230
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:168.061 g/mol
X log p:0.412  (online calculus)
Lipinksi Failures0
TPSA26.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:6
Rotatable Bond Count:2
Canonical Smiles:OCC(O)C1OC(=O)C(O)=C1O
Class:carbohydrate
Source:Vitamin C
Therapeutics:antiscorbutic, antiviral
Generic_name:ASCORBIC ACID
Chemical_iupac_name:ASCORBIC ACID
Drug_type:Experimental
Kegg_compound_id:C00072
Drugbank_id:EXPT00568
Melting_point:193oC
H2o_solubility:300 mg/mL
Logp:-1.305
Cas_registry_number:50-81-7
Drug_category:Hyaluronate Lyase inhibitor
Organisms_affected:-1

Found: 205 nonactive as graph: single | with analogs [1] << Back 81 82 83 84 85 86 87 88 89 90  Next >> [205]
Species: 4932
Condition: ROM2
Replicates: 2
Raw OD Value: r im 0.6396±0.0156271
Normalized OD Score: sc h 0.9591±0.0209471
Z-Score: -1.7893±0.861841
p-Value: 0.127245
Z-Factor: -57.8573
Fitness Defect: 2.0616
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:8|G7
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.00 Celcius
Date:2007-11-21 YYYY-MM-DD
Plate CH Control (+):0.040525±0.00171
Plate DMSO Control (-):0.65325±0.08994
Plate Z-Factor:0.5320
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DBLink | Rows returned: 1
439374

internal high similarity DBLink | Rows returned: 0

active | Cluster 176 | Additional Members: 3 | Rows returned: 0

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