COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK177295
Chemical Name: 7-{[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino}-3-{[(6-hydroxy-2-methyl-5-oxo-2,5-dihydro-1,2,4-triazin-3-yl)sulfanyl]methyl}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylat
Smiles: CO/N=C(\c1csc(n1)N)/C(=O)NC1C(=O)N2C1SCC(=C2C(=O)[O-])CSc1nc(=O)c(nn1C)O

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Saltdata: Na+
Molecular Weight: 553.58
Empirical Formula: C18H17N8O7S3

Physical State: Dry powder
Available Amount: 2953 mg

Lipinsky:
logP: -0.239
Rotatable bonds: 8
H-donors: 4
H-acceptors: 7
PSA: 294
Number of rings: 4

     

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