COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL046638
Chemical Name: 7-tert-butyl-2-(4-hydroxy-3-nitrophenyl)-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)c1ccc(c(c1)[N+](=O)[O-])O

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Molecular Weight: 401.49
Empirical Formula: C20H23N3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.017
Rotatable bonds: 2
H-donors: 3
H-acceptors: 4
PSA: 135
Number of rings: 4

     

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