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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: 37 active | as graph: single | with analogs 2 3 4 5 6 7 8 9 10  Next >> [37]
Species: 4932
Condition: BCK1
Replicates: 2
Raw OD Value: r im 0.6890±0
Normalized OD Score: sc h 0.7545±0.000696318
Z-Score: -8.4016±0.73868
p-Value: 0.00000000000000164711
Z-Factor: 0.832037
Fitness Defect: 34.0398
Bioactivity Statement: Active
Experimental Conditions
Library:Spectrum_ED
Plate Number and Position:1|C2
Drug Concentration:50.00 nM
OD Absorbance:595 nm
Robot Temperature:30.00 Celcius
Date:2010-08-10 YYYY-MM-DD
Plate CH Control (+):0.1015±0.00652
Plate DMSO Control (-):0.9765±0.01278
Plate Z-Factor:0.9338
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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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