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Compound InformationSONAR Target prediction
Name:

PHORBOL MYRISTATE ACETATE

Unique Identifier:SPE00330004
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
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:triterpene
Source:Euphorbia spp
Therapeutics:tumor promoter, PKC activator

Found: 192 nonactive as graph: single | with analogs 1 2 3 4 5 6 7 8 9 10  Next >> [192]
Species: 4932
Condition: APC9
Replicates: 2
Raw OD Value: r im 0.6935±0.00240416
Normalized OD Score: sc h 0.9982±0.00697698
Z-Score: -0.0966±0.377576
p-Value: 0.790436
Z-Factor: -10.028
Fitness Defect: 0.2352
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:21|G9
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:23.60 Celcius
Date:2007-11-22 YYYY-MM-DD
Plate CH Control (+):0.04235±0.00058
Plate DMSO Control (-):0.6687±0.13766
Plate Z-Factor:0.2940
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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
LOPAC 01158 1.0000

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