COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL539061
Chemical Name: (1S,5R)-3-(4-nitrobenzyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Smiles: O=c1cccc2n1C[C@H]1CN(C[C@@H]2C1)Cc1ccc(cc1)[N+](=O)[O-]

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Saltdata: HCl
Molecular Weight: 325.37
Empirical Formula: C18H19N3O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.636
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 69
Number of rings: 4

     

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