COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL047003
Chemical Name: 3-{5-[(Z)-(2-ethyl-5-iminio-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]furan-2-yl}benzoate
Smiles: CCc1nn2c(=NC(=O)/C(=C\c3ccc(o3)c3cccc(c3)C(=O)[O-])/C2=[NH2+])s1

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Molecular Weight: 394.41
Empirical Formula: C19H14N4O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.646
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 149
Number of rings: 4

     

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