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Compound InformationSONAR Target prediction
Name:

MIZORIBINE

Unique Identifier:SPE01503416
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C9H13N3O6
Molecular Weight:246.113 g/mol
X log p:2.276  (online calculus)
Lipinksi Failures0
TPSA41.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:9
Rotatable Bond Count:3
Canonical Smiles:NC(=O)c1ncn(C2OC(CO)C(O)C2O)c1O
Therapeutics:immunosuppressant

Found: 101 nonactive as graph: single | with analogs [1] << Back 51 52 53 54 55 56 57 58 59 60  Next >> [101]
Species: 4932
Condition: MRT4
Replicates: 2
Raw OD Value: r im 0.5656±0.00883884
Normalized OD Score: sc h 0.9962±0.008713
Z-Score: -0.1457±0.307572
p-Value: 0.82962
Z-Factor: -43.8282
Fitness Defect: 0.1868
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:23|B7
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.00 Celcius
Date:2007-08-30 YYYY-MM-DD
Plate CH Control (+):0.0406±0.00333
Plate DMSO Control (-):0.529175±0.01828
Plate Z-Factor:0.8530
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DBLink | Rows returned: 3
4213 1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-hydroxy-imidazole-4-carboxamide
104762 1-[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-hydroxy-imidazole-4-carboxamide
6603923 1-[(2R,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-hydroxy-imidazole-4-carboxamide

internal high similarity DBLink | Rows returned: 1
LOPAC 01041 1.0000

active | Cluster 9750 | Additional Members: 25 | Rows returned: 4
Prest466 0.433333333333333
SPE01502238 0.423728813559322
SPE01500667 0.258620689655172
Prest983 0

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