COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK782085
Chemical Name: 5-butyl-7-methyl-2-(5-nitrofuran-2-yl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Smiles: CCCCC12CN3CC(C2=O)(CN(C1)C3c1ccc(o1)[N+](=O)[O-])C

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Molecular Weight: 333.39
Empirical Formula: C17H23N3O4

Physical State: Dry powder
Available Amount: 67 mg

Lipinsky:
logP: 3.712
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 82
Number of rings: 5

     

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