Home | Screening data | Screen comparisons | Search for compounds | Structure search

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 61 62 63 64 65 66 67 68 69 70  Next >> [104]
Species: 4932
Condition: QCR8
Replicates: 2
Raw OD Value: r im 0.6783±0.000353553
Normalized OD Score: sc h 1.0312±0.00241782
Z-Score: 1.2880±0.101433
p-Value: 0.198892
Z-Factor: -1.65843
Fitness Defect: 1.615
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:18|B3
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.90 Celcius
Date:2008-04-25 YYYY-MM-DD
Plate CH Control (+):0.039775000000000005±0.00092
Plate DMSO Control (-):0.63915±0.01446
Plate Z-Factor:0.9351
png
ps
pdf

DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 14145 | Additional Members: 11 | Rows returned: 1
SPE01501176 0.195652173913043

Service provided by the Mike Tyers Laboratory