COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK091242
Chemical Name: (6E)-6-(3-bromo-5-methoxy-4-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}benzylidene)-5-imino-2-(propan-2-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: C=CCc1ccccc1OCCOc1c(Br)cc(cc1OC)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)C(C)C

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Molecular Weight: 583.51
Empirical Formula: C27H27BrN4O4S

Physical State: Dry powder
Available Amount: 130 mg

Lipinsky:
logP: 4.997
Rotatable bonds: 10
H-donors: 1
H-acceptors: 4
PSA: 121
Number of rings: 4

     

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