COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL549876
Chemical Name: (1S,5S)-3-(2,3-dihydro-1-benzofuran-6-ylacetyl)-9-nitro-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Smiles: O=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)c(cc1)[N+](=O)[O-])Cc1ccc2c(c1)OCC2

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Molecular Weight: 395.41
Empirical Formula: C21H21N3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.014
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 95
Number of rings: 5

     

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