COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK085972
Chemical Name: 2-{2-[2-(3,4-dimethylphenoxy)ethoxy]-5-nitrophenyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: [O-][N+](=O)c1ccc(c(c1)c1nc2sc3c(c2c(=O)[nH]1)CCCC3)OCCOc1ccc(c(c1)C)C

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Molecular Weight: 491.57
Empirical Formula: C26H25N3O5S

Physical State: Dry powder
Available Amount: 538 mg

Lipinsky:
logP: 6.237
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 133
Number of rings: 5

     

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