COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL525359
Chemical Name: (1S,5S)-3-{3-[(5E)-5-(3,4-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoyl}-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Smiles: COc1ccc(cc1OC)/C=C\1/SC(=S)N(C1=O)CCC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1

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Molecular Weight: 525.65
Empirical Formula: C26H27N3O5S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.656
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 136
Number of rings: 5

     

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