COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK383920
Chemical Name: 2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-7-(2-methylbutan-2-yl)-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4-ol
Smiles: CCC(C1CCc2c(C1)sc1c2C(=NC(N1)/C=C/c1ccc2c(c1)OCO2)O)(C)C

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Molecular Weight: 424.56
Empirical Formula: C24H28N2O3S

Physical State: Dry powder
Available Amount: 354 mg

Lipinsky:
logP: 6.454
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 91
Number of rings: 5

     

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