COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK061798
Chemical Name: (6E)-6-({1-[2-(2,6-dimethylphenoxy)ethyl]-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/c3cn(c4c3cccc4)CCOc3c(C)cccc3C)/C2=N)s1

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Molecular Weight: 485.61
Empirical Formula: C27H27N5O2S

Physical State: Dry powder
Available Amount: 441 mg

Lipinsky:
logP: 4.968
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 108
Number of rings: 5

     

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