COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK085400
Chemical Name: ethyl[1,5-dimethyl-9-oxo-7-(propylcarbamothioyl)-3,7-diazabicyclo[3.3.1]non-3-yl](oxo)acetate
Smiles: CCCNC(=S)N1CC2(C)CN(CC(C1)(C2=O)C)C(=O)C(=O)OCC

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Molecular Weight: 369.49
Empirical Formula: C17H27N3O4S

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 0.749
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 111
Number of rings: 2

     

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