COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK089312
Chemical Name: 4-{5-[(Z)-(2-heptyl-5-imino-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]furan-2-yl}benzoicacid
Smiles: CCCCCCCc1nn2c(=NC(=O)/C(=C\c3ccc(o3)c3ccc(cc3)C(=O)O)/C2=N)s1

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Molecular Weight: 464.55
Empirical Formula: C24H24N4O4S

Physical State: Dry powder
Available Amount: 444 mg

Lipinsky:
logP: 5.216
Rotatable bonds: 8
H-donors: 2
H-acceptors: 4
PSA: 144
Number of rings: 4

     

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