COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK544917
Chemical Name: 8-benzyl-4-(3-methylphenyl)-1-[(2-oxo-2-phenylethyl)sulfanyl]-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: Cc1cccc(c1)n1c(=O)c2c3CCN(Cc3sc2n2c1nnc2SCC(=O)c1ccccc1)Cc1ccccc1

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Molecular Weight: 577.73
Empirical Formula: C32H27N5O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.997
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 124
Number of rings: 7

     

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