COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL553482
Chemical Name: (1R,5S)-3-[(2-hydroxyquinolin-4-yl)carbonyl]-9-nitro-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Smiles: Oc1nc2ccccc2c(c1)C(=O)N1C[C@H]2CC(C1)c1n(C2)c(=O)c(cc1)[N+](=O)[O-]

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Molecular Weight: 406.4
Empirical Formula: C21H18N4O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.436
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 119
Number of rings: 5

     

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