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Compound InformationSONAR Target prediction
Name:

CAMPTOTHECIN

Unique Identifier:SPE01502232
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:332.225 g/mol
X log p:11.182  (online calculus)
Lipinksi Failures1
TPSA58.97
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:6
Rotatable Bond Count:1
Canonical Smiles:CCC1(O)C(=O)OCC2C(=O)N3Cc4cc5ccccc5nc4C3=CC=21
Class:alkaloid
Source:Camptotheca acuminata
Reference:J Am Chem Soc 88: 3888 (1966)
Therapeutics:antineoplastic

Found: 376 active | as graph: single | with analogs [1] << Back 371 372 373 374 375 376 Next >> [376]
Species: 4932
Condition: IRE1
Replicates: 2
Raw OD Value: r im 0.5980±0.00608112
Normalized OD Score: sc h 0.7962±0.0138285
Z-Score: -10.6915±1.07401
p-Value: 1.50935e-23
Z-Factor: 0.513246
Fitness Defect: 52.5478
Bioactivity Statement: Active
Experimental Conditions
Library:Spectrum_ED
Plate Number and Position:19|A8
Drug Concentration:50.00 nM
OD Absorbance:595 nm
Robot Temperature:30.00 Celcius
Date:2010-08-10 YYYY-MM-DD
Plate CH Control (+):0.09925±0.00939
Plate DMSO Control (-):0.9052499999999999±0.03145
Plate Z-Factor:0.8237
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DBLink | Rows returned: 5
2538
24360
32939
153546
184196

internal high similarity DBLink | Rows returned: 2
SPE01504123 0.9800
LOPAC 00814 1.0000

active | Cluster 1530 | Additional Members: 9 | Rows returned: 5
SPE01504123 0.178082191780822
LAT002A02 0
LOPAC 00814 0
Prest102 0
LAT003C09 0

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