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Compound InformationSONAR Target prediction
Name:

ACETYLCYSTEINE

Unique Identifier:SPE01500105
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:155.132 g/mol
X log p:-1.484  (online calculus)
Lipinksi Failures0
TPSA34.14
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:4
Canonical Smiles:CC(=O)NC(CS)C(O)=O
Source:synthetic
Therapeutics:mucolytic

Found: 192 nonactive as graph: single | with analogs [1] << Back 161 162 163 164 165 166 167 168 169 170  Next >> [192]
Species: 4932
Condition: ROT2
Replicates: 2
Raw OD Value: r im 0.8334±0
Normalized OD Score: sc h 1.0096±0.00162911
Z-Score: 0.4536±0.0706002
p-Value: 0.65052
Z-Factor: -3.03963
Fitness Defect: 0.43
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:10|D3
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.30 Celcius
Date:2006-05-05 YYYY-MM-DD
Plate CH Control (+):0.039675±0.00681
Plate DMSO Control (-):0.816425±0.02034
Plate Z-Factor:0.9094
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DBLink | Rows returned: 13<< Back 1 2 3 Next >> 
438650 2-acetamido-3-sulfanyl-propanoate; azanide; platinum(+4) cation
469105 (2S)-2-acetamido-2-carboxy-ethanethiolate; silver(+1) cation
499090 2-acetamido-3-sulfanyl-propanoic acid; azanide; platinum(+2) cation
3554025 (2-acetamido-3-sulfanyl-propanoyl)oxidanium
3614566 2-acetamido-2-carboxy-ethanethiolate; silver(+1) cation
5039298 (2-acetamido-3-sulfanyl-propanoyl)oxidanium; azanide; platinum(+4) cation

internal high similarity DBLink | Rows returned: 1
LOPAC 00353 1.0000

active | Cluster 12525 | Additional Members: 9 | Rows returned: 0
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