COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL404004
Chemical Name: 2-[5-(1,3-benzodioxol-5-yl)-1H-pyrazol-3-yl]-9-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CC1CCc2c(C1)sc1c2c2nc(nn2cn1)c1n[nH]c(c1)c1ccc2c(c1)OCO2

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Molecular Weight: 430.49
Empirical Formula: C22H18N6O2S

Physical State: Dry powder
Available Amount: 45 mg

Lipinsky:
logP: 6.008
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 118
Number of rings: 7

     

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