COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK017842
Chemical Name: (6Z)-6-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}benzylidene)-5-imino-2-(4-methylphenyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCC(c1ccc(cc1)OCCOc1ccc(cc1)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)c1ccc(cc1)C)C

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Molecular Weight: 538.67
Empirical Formula: C31H30N4O3S

Physical State: Dry powder
Available Amount: 196 mg

Lipinsky:
logP: 6.548
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 112
Number of rings: 5

     

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