COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK698739
Chemical Name: 3-{[(E)-(3-ethoxy-4-hydroxy-5-nitrophenyl)methylidene]amino}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CCOc1cc(/C=N/n2cnc3c(c2=O)c2CCCCc2s3)cc(c1O)[N+](=O)[O-]

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Molecular Weight: 414.44
Empirical Formula: C19H18N4O5S

Physical State: Dry powder
Available Amount: 138 mg

Lipinsky:
logP: 4.91
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 148
Number of rings: 4

     

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