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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 41 42 43 44 45 46 47 48 49 50  Next >> [71]
Species: 4932
Condition: NDI1
Replicates: 2
Raw OD Value: r im 0.6850±0.0374059
Normalized OD Score: sc h 0.9650±0.0432271
Z-Score: -1.6225±2.00072
p-Value: 0.418902
Z-Factor: -4.7767
Fitness Defect: 0.8701
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:5|E7
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:22.50 Celcius
Date:2008-03-13 YYYY-MM-DD
Plate CH Control (+):0.039425±0.00056
Plate DMSO Control (-):0.6878±0.01760
Plate Z-Factor:0.9036
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

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

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