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Compound InformationSONAR Target prediction
Name:

CHLORMADINONE ACETATE

Unique Identifier:SPE01505327
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C23ClH29O4
Molecular Weight:375.696 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:CC(=O)OC1(CCC2C3C=C(Cl)C4=CC(=O)CCC4(C)C3CCC21C)C(C)=O
Source:semisynthetic
Reference:Cancer Metastasis Rev 6:615 (1987); Endocrin J 42:505 (1995)
Therapeutics:progestin, antiandrogen

Found: 104 nonactive as graph: single | with analogs [1] << Back 11 12 13 14 15 16 17 18 19 20  Next >> [104]
Species: 4932
Condition: ABP1
Replicates: 2
Raw OD Value: r im 0.6990±0.00417193
Normalized OD Score: sc h 1.0084±0.0124981
Z-Score: 0.4114±0.616262
p-Value: 0.688738
Z-Factor: -12.3693
Fitness Defect: 0.3729
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:11|D8
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:22.80 Celcius
Date:2007-12-20 YYYY-MM-DD
Plate CH Control (+):0.0426±0.00145
Plate DMSO Control (-):0.66865±0.01467
Plate Z-Factor:0.9247
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 5652 | Additional Members: 7 | Rows returned: 5
SPE01500381 0.526315789473684
Prest1168 0.526315789473684
SPE01503921 0.303030303030303
LOPAC 00767 0
SPE01500216 0

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