COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK539128
Chemical Name: 1-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-4-(3-methylphenyl)-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: Brc1ccc(cc1)C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CCC3

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Molecular Weight: 551.49
Empirical Formula: C25H19BrN4O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.604
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 121
Number of rings: 6

     

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