COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL553521
Chemical Name: (1S,5S)-3-({[3-(3,4-dimethoxyphenyl)-2-oxo-2H-chromen-7-yl]oxy}acetyl)-9-nitro-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Smiles: COc1ccc(cc1OC)c1cc2ccc(cc2oc1=O)OCC(=O)N1C[C@H]2CC(C1)c1n(C2)c(=O)c(cc1)[N+](=O)[O-]

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Molecular Weight: 573.56
Empirical Formula: C30H27N3O9

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.401
Rotatable bonds: 6
H-donors: 0
H-acceptors: 9
PSA: 140
Number of rings: 6

     

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