COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552758
Chemical Name: (6R,7R)-3-[(acetyloxy)methyl]-7-{[(5R)-5-amino-5-carboxylatopentanoyl]amino}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Smiles: O=C(N[C@@H]1C(=O)N2[C@@H]1SCC(=C2C(=O)[O-])COC(=O)C)CCCC(C(=O)[O-])N

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Saltdata: Zn2+
Molecular Weight: 413.41
Empirical Formula: C16H19N3O8S

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: -0.202
Rotatable bonds: 7
H-donors: 3
H-acceptors: 8
PSA: 207
Number of rings: 2

     

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