COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK385577
Chemical Name: (6Z)-6-({1-[2-(3-ethyl-5-methylphenoxy)ethyl]-1H-indol-3-yl}methylidene)-2-heptyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCCCCCCc1sc2=NC(=O)/C(=C\c3cn(c4c3cccc4)CCOc3cc(C)cc(c3)CC)/C(=N)n2n1

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Molecular Weight: 555.74
Empirical Formula: C32H37N5O2S

Physical State: Dry powder
Available Amount: 194 mg

Lipinsky:
logP: 7.625
Rotatable bonds: 12
H-donors: 1
H-acceptors: 2
PSA: 108
Number of rings: 5

     

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