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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 331 332 333 334 335 336 337 338 339 340  Next >> [376]
Species: 4932
Condition: RSA3
Replicates: 2
Raw OD Value: r im 0.4693±0.0799031
Normalized OD Score: sc h 0.6928±0.0809615
Z-Score: -13.1607±3.39445
p-Value: 2.64554e-27
Z-Factor: -0.0116608
Fitness Defect: 61.1969
Bioactivity Statement: Active
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:14|A9
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:23.60 Celcius
Date:2008-04-01 YYYY-MM-DD
Plate CH Control (+):0.03985±0.00061
Plate DMSO Control (-):0.678125±0.01520
Plate Z-Factor:0.9099
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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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