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Compound InformationSONAR Target prediction
Name:

ERYTHROMYCIN

Unique Identifier:SPE01500280
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C37H67NO13
Molecular Weight:666.395 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:CCC1OC(=O)C(C)C(OC2CC(C)(OC)C(O)C(C)O2)C(C)C(OC2OC(C)CC(C2O)N(C)C)C(C)
(O)CC(C)C(=O)C(C)C(O)C1(C)O
Class:macrolide
Source:Streptomyces erythreus
Therapeutics:antibacterial

Found: 104 nonactive as graph: single | with analogs [1] << Back 11 12 13 14 15 16 17 18 19 20  Next >> [104]
Species: 4932
Condition: AAT2
Replicates: 2
Raw OD Value: r im 0.7352±0.00148492
Normalized OD Score: sc h 1.0185±0.00812399
Z-Score: 0.9887±0.452907
p-Value: 0.347184
Z-Factor: -2.25596
Fitness Defect: 1.0579
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:18|B3
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.90 Celcius
Date:2008-04-08 YYYY-MM-DD
Plate CH Control (+):0.03995±0.00106
Plate DMSO Control (-):0.7078500000000001±0.01136
Plate Z-Factor:0.9386
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 14145 | Additional Members: 11 | Rows returned: 101 2 Next >> 
SPE01504144 0.320754716981132
Prest923 0.320754716981132
SPE01503276 0.264705882352941
Prest1046 0.264705882352941
SPE01500279 0.221052631578947
SPE01503679 0.206521739130435

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