COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK213644
Chemical Name: 3-(7-tert-butyl-4-hydroxy-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)phenyl1,3-benzodioxole-5-carboxylate
Smiles: OC1=NC(Nc2c1c1CCC(Cc1s2)C(C)(C)C)c1cccc(c1)OC(=O)c1ccc2c(c1)OCO2

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Molecular Weight: 504.61
Empirical Formula: C28H28N2O5S

Physical State: Dry powder
Available Amount: 42 mg

Lipinsky:
logP: 5.541
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 117
Number of rings: 6

     

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