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Compound InformationSONAR Target prediction
Name:

12a-HYDROXY-5-DEOXYDEHYDROMUNDUSERONE

Unique Identifier:SPE00202175
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:324.2 g/mol
X log p:13.364  (online calculus)
Lipinksi Failures1
TPSA46.15
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:6
Rotatable Bond Count:3
Canonical Smiles:COc1ccc2C=C3c4cc(OC)c(OC)cc4OCC3(O)Oc2c1
Class:rotenoid
Source:derivative

Found: 604 nonactive | as graph: single | with analogs [1] << Back 511 512 513 514 515 516 517 518 519 520  Next >> [604]
Species: 4932
Condition: BNI1
Replicates: 2
Raw OD Value: r im 0.6724±0.00982878
Normalized OD Score: sc h 0.9798±0.0094821
Z-Score: -0.9923±0.436961
p-Value: 0.3438
Z-Factor: -4.94192
Fitness Defect: 1.0677
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:23|F4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.00 Celcius
Date:2007-09-14 YYYY-MM-DD
Plate CH Control (+):0.0429±0.00220
Plate DMSO Control (-):0.6773750000000001±0.01899
Plate Z-Factor:0.9120
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DBLink | Rows returned: 1
4620898

internal high similarity DBLink | Rows returned: 0

active | Cluster 1665 | Additional Members: 1 | Rows returned: 0
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