COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK568018
Chemical Name: 3-(5-{(Z)-[5-iminio-7-oxo-2-(pyridin-3-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}furan-2-yl)benzoate
Smiles: O=C1N=c2sc(nn2C(=[NH2+])/C/1=C/c1ccc(o1)c1cccc(c1)C(=O)[O-])c1cccnc1

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Molecular Weight: 443.44
Empirical Formula: C22H13N5O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.375
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 162
Number of rings: 5

     

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