COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK030845
Chemical Name: 3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-8-oxo-7-[(1H-tetrazol-1-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Smiles: O=C(NC1C(=O)N2C1SCC(=C2C(=O)[O-])CSc1nnc(s1)C)Cn1cnnn1

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Saltdata: Na+
Molecular Weight: 453.51
Empirical Formula: C14H13N8O4S3

Physical State: Dry powder
Available Amount: 1087 mg

Lipinsky:
logP: 1.133
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 237
Number of rings: 4

     

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