COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK778562
Chemical Name: 8-({[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl}sulfanyl)-1,3-dimethyl-7-[3-(trifluoromethyl)benzyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Nc1nc(CSc2nc3c(n2Cc2cccc(c2)C(F)(F)F)c(=O)n(c(=O)n3C)C)nc(n1)N(C)C

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Molecular Weight: 521.53
Empirical Formula: C21H22F3N9O2S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 1.855
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 151
Number of rings: 4

     

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