COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL545451
Chemical Name: methyl3-(2H-chromen-3-yl)-3-(3-hydroxy-4-oxo-6-{[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]methyl}-4H-pyran-2-yl)propanoate
Smiles: COC(=O)CC(c1oc(CN2C[C@H]3C[C@@H](C2)c2n(C3)c(=O)ccc2)cc(=O)c1O)C1=Cc2c(OC1)cccc2

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Molecular Weight: 530.58
Empirical Formula: C30H30N2O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.634
Rotatable bonds: 8
H-donors: 1
H-acceptors: 7
PSA: 105
Number of rings: 6

     

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