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

Compound InformationSONAR Target prediction
Name:

TACROLIMUS

Unique Identifier:SPE01503968
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C44H69NO12
Molecular Weight:734.47 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:COC1CC(CCC1O)C=C(C)C1OC(=O)C2CCCCN2C(=O)C(=O)C2(O)OC(C(CC(C)CC(C)=CC(C
C=C)C(=O)CC(O)C1C)OC)C(CC2C)OC
Source:Streptomyces tsukubaensis
Therapeutics:immune suppressant, antifungal

Found: 71 nonactive | as graph: single | with analogs [1] << Back 51 52 53 54 55 56 57 58 59 60  Next >> [71]
Species: 4932
Condition: SDH2
Replicates: 2
Raw OD Value: r im 0.7800±0.00487904
Normalized OD Score: sc h 1.0467±0.00102088
Z-Score: 2.5987±0.0920089
p-Value: 0.00950668
Z-Factor: -0.0805537
Fitness Defect: 4.6558
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:5|E7
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.10 Celcius
Date:2008-04-18 YYYY-MM-DD
Plate CH Control (+):0.042175±0.00100
Plate DMSO Control (-):0.7228749999999999±0.01083
Plate Z-Factor:0.9517
png
ps
pdf

DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 4292 | Additional Members: 3 | Rows returned: 1
SPE01504008 0

Service provided by the Mike Tyers Laboratory