COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK382638
Chemical Name: 2-(6-bromo-1,3-benzodioxol-5-yl)-7-tert-butyl-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one
Smiles: O=C1NC(Nc2c1c1CCC(Cc1s2)C(C)(C)C)c1cc2OCOc2cc1Br

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Molecular Weight: 463.4
Empirical Formula: C21H23BrN2O3S

Physical State: Dry powder
Available Amount: 606 mg

Lipinsky:
logP: 5.293
Rotatable bonds: 1
H-donors: 2
H-acceptors: 3
PSA: 87
Number of rings: 5

     

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