Compound Information | SONAR Target prediction | Name: | Pivampicillin | Unique Identifier: | Prest1280 | MolClass: | Checkout models in ver1.5 and ver1.0 | Molecular Formula: | C22H29N3O6S | Molecular Weight: | 436.334 g/mol | X log p: | 8.274 (online calculus) | Lipinksi Failures | 1 | TPSA | 115.28 | Hydrogen Bond Donor Count: | 0 | Hydrogen Bond Acceptors Count: | 9 | Rotatable Bond Count: | 10 | Canonical Smiles: | CC(C)(C)C(=O)OCOC(=O)C1N2C(SC1(C)C)C(NC(=O)C(N)c1ccccc1)C2=O |
Species: |
9606 |
Condition: |
TMPPre003 |
Replicates: |
2 |
Raw OD Value: r im |
9843.0000±0 |
Normalized OD Score: sc h |
0.8340±0 |
Z-Score: |
-4.6191±0 |
p-Value: |
0.00000385384 |
Z-Factor: |
-3.34171 |
Fitness Defect: |
12.4664 |
Bioactivity Statement: |
Active |
Experimental Conditions | | Library: | Prestwick | Plate Number and Position: | 13|E10 | Drug Concentration: | 50.00 nM | OD Absorbance: | 0 nm | Robot Temperature: | 23.50 Celcius | Date: | 2006-10-10 YYYY-MM-DD | Plate CH Control (+): | 22091.5±7532.35178 | Plate DMSO Control (-): | 12139.5±7461.51552 | Plate Z-Factor: | -5.4357 |
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DBLink | Rows returned: 5 | |
33477 |
2,2-dimethylpropanoyloxymethyl (2S,5R,6R)-6-[[(2R)-2-amino-2-phenyl-acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane- 2-carboxylate hydrochloride |
33478 |
2,2-dimethylpropanoyloxymethyl (2S,5R,6R)-6-[[(2R)-2-amino-2-phenyl-acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane- 2-carboxylate |
126935 |
2,2-dimethylpropanoyloxymethyl (2S,5R,6R)-6-[(2-amino-2-phenyl-acetyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-car boxylate |
4490793 |
2,2-dimethylpropanoyloxymethyl 6-[(2-amino-2-phenyl-acetyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate |
6604391 |
2,2-dimethylpropanoyloxymethyl (2S,5R,6R)-6-[[(2S)-2-amino-2-phenyl-acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane- 2-carboxylate |
internal high similarity DBLink | Rows returned: 0 | |
active | Cluster 15024 | Additional Members: 10 | Rows returned: 2 | |
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