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Compound InformationSONAR Target prediction
Name:

OXACILLIN SODIUM

Unique Identifier:SPE01500448
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:406.284 g/mol
X log p:9.308  (online calculus)
Lipinksi Failures1
TPSA124.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:6
Rotatable Bond Count:5
Canonical Smiles:[Na+].[O-]C(=O)C1N2C(SC1(C)C)C(NC(=O)c1c(C)onc1c1ccccc1)C2=O
Source:semisynthetic
Therapeutics:antibacterial

Found: 204 nonactive | as graph: single | with analogs [1] << Back 161 162 163 164 165 166 167 168 169 170  Next >> [204]
Species: 4932
Condition: PFK2
Replicates: 2
Raw OD Value: r im 0.5094±0.00997021
Normalized OD Score: sc h 1.0460±0.0119562
Z-Score: 1.4736±0.379396
p-Value: 0.15481
Z-Factor: -1.11399
Fitness Defect: 1.8656
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:19|B6
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.50 Celcius
Date:2008-05-10 YYYY-MM-DD
Plate CH Control (+):0.0404±0.00076
Plate DMSO Control (-):0.4779±0.01129
Plate Z-Factor:0.9187
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DBLink | Rows returned: 221 2 3 4 Next >> 
4607 3,3-dimethyl-6-[(5-methyl-3-phenyl-oxazole-4-carbonyl)amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-c
arboxylate
4608 3,3-dimethyl-6-[(5-methyl-3-phenyl-oxazole-4-carbonyl)amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-c
arboxylic acid
6196 (2S,5R,6R)-3,3-dimethyl-6-[(5-methyl-3-phenyl-oxazole-4-carbonyl)amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]
heptane-2-carboxylic acid
23663 sodium
3,3-dimethyl-6-[(5-methyl-3-phenyl-oxazole-4-carbonyl)amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-c
arboxylate
64714 sodium
(2S,5R,6R)-3,3-dimethyl-6-[(5-methyl-3-phenyl-oxazole-4-carbonyl)amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]
heptane-2-carboxylate
441399 sodium
(2S,5R,6R)-3,3-dimethyl-6-[(5-methyl-3-phenyl-oxazole-4-carbonyl)amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]
heptane-2-carboxylate hydrate

internal high similarity DBLink | Rows returned: 2
SPE01500201 0.9526
SPE01500238 0.9526

active | Cluster 3276 | Additional Members: 16 | Rows returned: 0
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