COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL452990
Chemical Name: 7-{[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-{[(2-carboxypropan-2-yl)oxy]imino}acetyl]amino}-8-oxo-3-(pyridinium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylate
Smiles: [O-]C(=O)C1C(=CSC2N1C(=O)C2NC(=O)/C(=N/OC(C(=O)O)(C)C)/c1csc(n1)N)C[n+]1ccccc1

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Molecular Weight: 546.58
Empirical Formula: C22H22N6O7S2

Available Amount: 0 mg

Lipinsky:
logP: -1.737
Rotatable bonds: 8
H-donors: 4
H-acceptors: 7
PSA: 244
Number of rings: 4

     

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