COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK805090
Chemical Name: 4-(4-methoxyphenyl)-1-[(2-methylprop-2-en-1-yl)sulfanyl]-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: COc1ccc(cc1)n1c2nnc(n2c2c(c1=O)c1CCCCc1s2)SCC(=C)C

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Molecular Weight: 438.57
Empirical Formula: C22H22N4O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.76
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 113
Number of rings: 5

     

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