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Compound InformationSONAR Target prediction
Name:

METHICILLIN SODIUM

Unique Identifier:SPE01500395
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:383.248 g/mol
X log p:5.686  (online calculus)
Lipinksi Failures1
TPSA121.27
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:8
Rotatable Bond Count:6
Canonical Smiles:[Na+].[O-]C(=O)C1N2C(SC1(C)C)C(NC(=O)c1c(OC)cccc1OC)C2=O
Source:semisynthetic
Therapeutics:antibacterial

Found: 205 nonactive as graph: single | with analogs [1] << Back 181 182 183 184 185 186 187 188 189 190  Next >> [205]
Species: 4932
Condition: SEC22
Replicates: 2
Raw OD Value: r im 0.6618±0.0401637
Normalized OD Score: sc h 0.9932±0.0103838
Z-Score: -0.2277±0.349561
p-Value: 0.80967
Z-Factor: -11.3367
Fitness Defect: 0.2111
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:20|H11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:23.20 Celcius
Date:2007-10-16 YYYY-MM-DD
Plate CH Control (+):0.039650000000000005±0.00174
Plate DMSO Control (-):0.65785±0.01586
Plate Z-Factor:0.8884
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DBLink | Rows returned: 14<< Back 1 2 3
6917651 sodium
(5R,6R)-6-[(2,6-dimethoxybenzoyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxyla
te hydrate
6917652 (5R,6R)-6-[(2,6-dimethoxybenzoyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxyli
c acid

internal high similarity DBLink | Rows returned: 0

active | Cluster 3276 | Additional Members: 16 | Rows returned: 1
SPE01500448 0.459459459459459

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