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Compound InformationSONAR Target prediction
Name:

RIFAXIMIN

Unique Identifier:SPE01505321
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C43H51N3O11
Molecular Weight:734.474 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:COC1C=COC2(C)Oc3c(C)c(O)c4c(O)c(NC(=O)C(C)=CC=CC(C)C(O)C(C)C(O)C(C)C(O
C(C)=O)C1C)c1n5C=CC(C)=Cc5nc1c4c3C2=O
Source:semisynthetic
Reference:Drugs 49:467 (1995)
Therapeutics:antibacterial, RNA synthesis inhibitor

Found: 104 nonactive as graph: single | with analogs [1] << Back 101 102 103 104
Species: 4932
Condition: YPT6
Replicates: 2
Raw OD Value: r im 0.5874±0.0195869
Normalized OD Score: sc h 1.0901±0.0181863
Z-Score: 2.5094±0.506474
p-Value: 0.0177969
Z-Factor: -0.708466
Fitness Defect: 4.0287
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:17|D6
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.70 Celcius
Date:2008-06-05 YYYY-MM-DD
Plate CH Control (+):0.041025±0.00106
Plate DMSO Control (-):0.5222249999999999±0.01804
Plate Z-Factor:0.8723
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 6557 | Additional Members: 7 | Rows returned: 3
Prest1296 0.411764705882353
SPE01500529 0
Prest833 0

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