COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK926051
Chemical Name: 1-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-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: CC1CCc2c(C1)sc1c2c(=O)n(c2n1c(SCc1ccc3c(c1)OCO3)nn2)c1ccccc1

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Molecular Weight: 502.62
Empirical Formula: C26H22N4O3S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.595
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 123
Number of rings: 7

     

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