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Compound InformationSONAR Target prediction
Name:

CEFDINIR

Unique Identifier:SPE01505208
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:382.312 g/mol
X log p:2.057  (online calculus)
Lipinksi Failures0
TPSA129.77
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:8
Rotatable Bond Count:6
Canonical Smiles:Nc1scc(n1)C(=NO)C(=O)NC1C2SCC(C=C)=C(N2C1=O)C(O)=O
Source:semisynthetic; CL-983, FK-482
Therapeutics:antibacterial

Found: 205 nonactive as graph: single | with analogs 1 2 3 4 5 6 7 8 9 10  Next >> [205]
Species: 4932
Condition: AAT2
Replicates: 2
Raw OD Value: r im 0.7515±0.00353553
Normalized OD Score: sc h 1.0222±0.00036236
Z-Score: 1.1769±0.0448552
p-Value: 0.239456
Z-Factor: -1.852
Fitness Defect: 1.4294
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:5|B6
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:23.70 Celcius
Date:2008-04-08 YYYY-MM-DD
Plate CH Control (+):0.0402±0.00073
Plate DMSO Control (-):0.7159±0.01647
Plate Z-Factor:0.9139
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DBLink | Rows returned: 71 2 Next >> 
6398970 (6R,7R)-7-[[2-(2-amino-1,3-thiazol-4-yl)-2-hydroxyimino-acetyl]amino]-3-ethenyl-8-oxo-5-thia-1-azabicycl
o[4.2.0]oct-2-ene-2-carboxylic acid
6399011 7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-hydroxyimino-acetyl]amino]-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4
.2.0]oct-2-ene-2-carboxylic acid
6399253 (6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-hydroxyimino-acetyl]amino]-3-ethenyl-8-oxo-5-thia-1-azab
icyclo[4.2.0]oct-2-ene-2-carboxylic acid
6413100 7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-hydroxyimino-acetyl]amino]-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4
.2.0]oct-2-ene-2-carboxylic acid
6803597 7-[[2-(2-amino-1,3-thiazol-4-yl)-2-hydroxyimino-acetyl]amino]-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]
oct-2-ene-2-carboxylic acid
6915944 (6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-hydroxyimino-acetyl]amino]-3-ethenyl-8-oxo-5-thia-1-azab
icyclo[4.2.0]oct-2-ene-2-carboxylic acid

internal high similarity DBLink | Rows returned: 0

active | Cluster 437 | Additional Members: 14 | Rows returned: 2
SPE01503111 0.340425531914894
SPE01502033 0.289156626506024

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