COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL562142
Chemical Name: (1S)-3-[2-hydroxy-3-(prop-2-en-1-ylsulfinyl)propyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Smiles: C=CCS(=O)CC(CN1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)O

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Molecular Weight: 336.46
Empirical Formula: C17H24N2O3S

Physical State: Dry powder
Available Amount: 219 mg

Lipinsky:
logP: 0.332
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 80
Number of rings: 3

     

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