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Compound InformationSONAR Target prediction
Name:

ASIATIC ACID

Unique Identifier:SPE01505175
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C30H48O5
Molecular Weight:440.318 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:CC1CCC2(CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(CO)C5CCC43C)C2C1C)C(O)=O
Class:triterpene
Source:Dipterocarpus pilosus, Dryobalanops aromatica
Reference:Bull Soc Chim Fr 1959:880; 1961:1586; J Chem Soc 1961:646; Phytochemistry 8:917
(1969)
Therapeutics:wound healing, experimental carcinogen

Found: 103 nonactive | as graph: single | with analogs [1] << Back 61 62 63 64 65 66 67 68 69 70  Next >> [103]
Species: 4932
Condition: PEP5
Replicates: 2
Raw OD Value: r im 0.7072±0.00629325
Normalized OD Score: sc h 1.0320±0.00089081
Z-Score: 1.7947±0.108875
p-Value: 0.0735488
Z-Factor: -1.19106
Fitness Defect: 2.6098
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:23|D7
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.80 Celcius
Date:2008-08-14 YYYY-MM-DD
Plate CH Control (+):0.048775±0.00204
Plate DMSO Control (-):0.67435±0.01657
Plate Z-Factor:0.9084
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 1869 | Additional Members: 9 | Rows returned: 3
SPE00307045 0.452380952380952
SPE01505250 0.417721518987342
SPE01800031 0

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