COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK560837
Chemical Name: 4-[(E)-{5-iminio-2-[2-(morpholin-4-yl)-2-oxoethyl]-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene}methyl]-2,6-dimethoxyphenolate
Smiles: COc1cc(/C=C\2/C(=O)N=c3n(C2=[NH2+])nc(s3)CC(=O)N2CCOCC2)cc(c1[O-])OC

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Molecular Weight: 459.48
Empirical Formula: C20H21N5O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -0.683
Rotatable bonds: 4
H-donors: 2
H-acceptors: 6
PSA: 166
Number of rings: 4

     

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