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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 11 12 13 14 15 16 17 18 19 20  Next >> [101]
Species: 4932
Condition: CKA2
Replicates: 2
Raw OD Value: r im 0.8564±0.0114551
Normalized OD Score: sc h 1.0035±0.00206823
Z-Score: 0.1291±0.0801838
p-Value: 0.897406
Z-Factor: -8.7729
Fitness Defect: 0.1082
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:23|B7
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.10 Celcius
Date:2006-04-03 YYYY-MM-DD
Plate CH Control (+):0.039325±0.00112
Plate DMSO Control (-):0.830775±0.01746
Plate Z-Factor:0.9324
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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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