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Compound InformationSONAR Target prediction
Name:

MUNDULONE

Unique Identifier:SPE00200011
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C26H26O6
Molecular Weight:408.275 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:COc1c2C=CC(C)(C)Oc2ccc1C1=COc2cc3OC(C)(C)C(O)Cc3cc2C1=O
Class:isoflavone
Source:Mundulea sericea
Reference:Tet Letters 1963, 281

Found: 100 nonactive | as graph: single | with analogs [1] << Back 71 72 73 74 75 76 77 78 79 80  Next >> [100]
Species: 4932
Condition: STO1
Replicates: 2
Raw OD Value: r im 0.6092±0.0128693
Normalized OD Score: sc h 0.9878±0.00630075
Z-Score: -0.4328±0.217062
p-Value: 0.66883
Z-Factor: -11.6309
Fitness Defect: 0.4022
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:10|A3
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.00 Celcius
Date:2007-12-06 YYYY-MM-DD
Plate CH Control (+):0.041525±0.00148
Plate DMSO Control (-):0.6028±0.01525
Plate Z-Factor:0.9037
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 2161 | Additional Members: 6 | Rows returned: 2
SPE00210203 0
LAT001H03 0

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