COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL551499
Chemical Name: (1S,5R)-3-[3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoyl]-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-])CCc1c(=O)oc2c(c1C)ccc(c2C)O

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Molecular Weight: 479.49
Empirical Formula: C25H25N3O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.586
Rotatable bonds: 4
H-donors: 1
H-acceptors: 7
PSA: 132
Number of rings: 5

     

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