COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK698741
Chemical Name: 3-({(E)-[3-bromo-4-(2,4-dinitrophenoxy)-5-methoxyphenyl]methylidene}amino)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: COc1cc(/C=N/n2cnc3c(c2=O)c2CCCCc2s3)cc(c1Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])Br

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Molecular Weight: 600.41
Empirical Formula: C24H18BrN5O7S

Physical State: Dry powder
Available Amount: 185 mg

Lipinsky:
logP: 5.236
Rotatable bonds: 5
H-donors: 0
H-acceptors: 7
PSA: 183
Number of rings: 5

     

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