COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK308629
Chemical Name: 3-[(acetyloxy)methyl]-7-{[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetyl]amino}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Smiles: O=C(Cn1nc(c(c1C)[N+](=O)[O-])C)NC1C(=O)N2C1SCC(=C2C(=O)[O-])COC(=O)C

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Saltdata: Na+
Molecular Weight: 452.42
Empirical Formula: C17H18N5O8S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 1.38
Rotatable bonds: 6
H-donors: 1
H-acceptors: 8
PSA: 204
Number of rings: 3

     

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