COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK384814
Chemical Name: 3-(4-hydroxy-7-methyl-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)phenyl4-nitrobenzoate
Smiles: CC1CCc2c(C1)sc1c2C(=NC(N1)c1cccc(c1)OC(=O)c1ccc(cc1)[N+](=O)[O-])O

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Molecular Weight: 463.51
Empirical Formula: C24H21N3O5S

Physical State: Dry powder
Available Amount: 377 mg

Lipinsky:
logP: 4.862
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 144
Number of rings: 5

     

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