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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: 255 nonactive | as graph: single | with analogs 1 2 3 4 5 6 7 8 9 10  Next >> [255]
Species: 4932
Condition: SPE01502260
Replicates: 2
Raw OD Value: r im 0.3143±0
Normalized OD Score: sc h 0.8770±0
Z-Score: -1.9936±0
p-Value: 0.0461946
Z-Factor: -0.528588
Fitness Defect: 3.0749
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SpectrumTMP
Plate Number and Position:2|H9
Drug Concentration:50.00 nM
OD Absorbance:0 nm
Robot Temperature:0.00 Celcius
Date:2006-08-13 YYYY-MM-DD
Plate CH Control (+):0.04055±0.00091
Plate DMSO Control (-):0.3584±0.02117
Plate Z-Factor:0.7899
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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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