COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL553132
Chemical Name: N-{[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]carbonothioyl}-4-propoxybenzamide
Smiles: CCCOc1ccc(cc1)C(=O)NC(=S)N1C[C@H]2CC(C1)c1n(C2)c(=O)ccc1

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Molecular Weight: 411.52
Empirical Formula: C22H25N3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.161
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 93
Number of rings: 4

     

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