COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK014433
Chemical Name: (6Z)-2-butyl-6-{4-[(2-chlorobenzyl)oxy]-3-methoxybenzylidene}-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCCCc1nn2c(=NC(=O)/C(=C\c3ccc(c(c3)OC)OCc3ccccc3Cl)/C2=N)s1

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Molecular Weight: 482.99
Empirical Formula: C24H23ClN4O3S

Physical State: Dry powder
Available Amount: 92 mg

Lipinsky:
logP: 4.516
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 112
Number of rings: 4

     

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