COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL549512
Chemical Name: N-(1-{2-[(1S,5R)-9-nitro-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]-2-oxoethyl}-1H-indol-4-yl)acetamide
Smiles: CC(=O)Nc1cccc2c1ccn2CC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)c(cc1)[N+](=O)[O-]

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Molecular Weight: 449.47
Empirical Formula: C23H23N5O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.489
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 120
Number of rings: 5

     

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