COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL525595
Chemical Name: (1S)-3-{2-methoxy-5-[(1E)-3-oxo-3-phenylprop-1-en-1-yl]benzyl}-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Smiles: COc1ccc(cc1CN1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)/C=C/C(=O)c1ccccc1

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Molecular Weight: 440.54
Empirical Formula: C28H28N2O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.646
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 49
Number of rings: 5

     

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