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Compound InformationSONAR Target prediction
Name:

Phorbol 12-myristate 13-acetate

Unique Identifier:LOPAC 01158
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C36H56O8
Molecular Weight:563.404 g/mol
X log p:1.237  (online calculus)
Lipinksi Failures1
TPSA69.67
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:8
Rotatable Bond Count:17
Canonical Smiles:CCCCCCCCCCCCCC(=O)OC1C(C)C2(O)C(C=C(CO)CC3(O)C2C=C(C)C3=O)C2C(C)(C)C12
OC(C)=O
Class:Phosphorylation
Action:Activator
Selectivity:PKC

Found: 24 nonactive as graph: single | with analogs [1] << Back 21 22 23 24
Species: 4932
Condition: WHI5
Replicates: 2
Raw OD Value: r im 0.6454±0.0124451
Normalized OD Score: sc h 1.0066±0.00316057
Z-Score: 0.2051±0.119532
p-Value: 0.838072
Z-Factor: -5.08807
Fitness Defect: 0.1767
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:13|H3
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:0.00 Celcius
Date:2005-04-20 YYYY-MM-DD
Plate CH Control (+):0.046475±0.00089
Plate DMSO Control (-):0.660975±0.05638
Plate Z-Factor:0.7296
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DBLink | Rows returned: 401 2 3 4 5 6 7 Next >> 
4792
27924
37783
122634
124027
124127

internal high similarity DBLink | Rows returned: 1
SPE00330004 1.0000

active | Cluster 717 | Additional Members: 7 | Rows returned: 0
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