COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK544995
Chemical Name: 1-(heptylsulfanyl)-4-(2-phenylethyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CCCCCCCSc1nnc2n1c1sc3c(c1c(=O)n2CCc1ccccc1)CCCC3

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Molecular Weight: 480.7
Empirical Formula: C26H32N4OS2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 9.093
Rotatable bonds: 9
H-donors: 0
H-acceptors: 1
PSA: 104
Number of rings: 5

     

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