COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL049908
Chemical Name: (4-{(Z)-[2-(2-cyclohexylethyl)-5-iminio-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}phenoxy)acetate
Smiles: [O-]C(=O)COc1ccc(cc1)/C=C/1\C(=O)N=c2n(C1=[NH2+])nc(s2)CCC1CCCCC1

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Molecular Weight: 440.52
Empirical Formula: C22H24N4O4S

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 3.119
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 145
Number of rings: 4

     

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