COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL407763
Chemical Name: N-(6-methyl-2-nonyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-3,5-dinitrobenzamide
Smiles: CCCCCCCCCc1nc2sc3c(c2c(=O)n1NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])CC(CC3)C

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Molecular Weight: 555.66
Empirical Formula: C27H33N5O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.531
Rotatable bonds: 9
H-donors: 1
H-acceptors: 6
PSA: 181
Number of rings: 4

     

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