COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK712122
Chemical Name: (6Z)-6-(4-{2-[2-(3,4-dimethylphenoxy)ethoxy]ethoxy}benzylidene)-5-imino-2-propyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCCc1nn2c(=NC(=O)/C(=C\c3ccc(cc3)OCCOCCOc3ccc(c(c3)C)C)/C2=N)s1

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Molecular Weight: 506.63
Empirical Formula: C27H30N4O4S

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 4.319
Rotatable bonds: 9
H-donors: 1
H-acceptors: 4
PSA: 121
Number of rings: 4

     

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