COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL553081
Chemical Name: 3,4-dimethoxy-N-{[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]carbonothioyl}benzamide
Smiles: COc1ccc(cc1OC)C(=O)NC(=S)N1C[C@H]2CC(C1)c1n(C2)c(=O)ccc1

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Molecular Weight: 413.5
Empirical Formula: C21H23N3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.17
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 103
Number of rings: 4

     

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