COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK028089
Chemical Name: (6E)-6-{[1-(2-chlorobenzyl)-2-methyl-1H-indol-3-yl]methylidene}-5-imino-2-propyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCCc1nn2c(=NC(=O)/C(=C/c3c(C)n(c4c3cccc4)Cc3ccccc3Cl)/C2=N)s1

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Molecular Weight: 476
Empirical Formula: C25H22ClN5OS

Physical State: Dry powder
Available Amount: 94 mg

Lipinsky:
logP: 4.99
Rotatable bonds: 5
H-donors: 1
H-acceptors: 1
PSA: 99
Number of rings: 5

     

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