COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK531114
Chemical Name: 1-(heptylsulfanyl)-8-methyl-4-phenyl-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)n2c1ccccc1)CCC(C3)C

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Molecular Weight: 466.67
Empirical Formula: C25H30N4OS2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 9.145
Rotatable bonds: 7
H-donors: 0
H-acceptors: 1
PSA: 104
Number of rings: 5

     

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