COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK188385
Chemical Name: (6E)-6-({1-[2-(4-tert-butylphenoxy)ethyl]-2,5-dimethyl-1H-indol-3-yl}methylidene)-5-imino-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: Cc1ccc2c(c1)c(/C=C\1/C(=O)N=c3n(C1=N)nc(s3)C(F)(F)F)c(n2CCOc1ccc(cc1)C(C)(C)C)C

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Molecular Weight: 567.64
Empirical Formula: C29H28F3N5O2S

Physical State: Dry powder
Available Amount: 356 mg

Lipinsky:
logP: 7.117
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 108
Number of rings: 5

     

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