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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 2 3 4 5 6 7 8 9 10  Next >> [24]
Species: 4932
Condition: BY4741
Replicates: 8
Raw OD Value: r im 0.7613±0.0418036
Normalized OD Score: sc h 0.9939±0.0288172
Z-Score: -0.2965±0.936424
p-Value: 0.569
Z-Factor: -664.331
Fitness Defect: 0.5639
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:13|H3
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.80 Celcius
Date:2005-04-07 YYYY-MM-DD
Plate CH Control (+):0.04800625000000002±0.00227
Plate DMSO Control (-):0.7375000000000003±0.02694
Plate Z-Factor:0.9214
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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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