COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL547939
Chemical Name: (1S,5S)-3-{3-[3,5-dimethyl-1-(2-methylprop-2-en-1-yl)-1H-pyrazol-4-yl]propanoyl}-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Smiles: CC(=C)Cn1nc(c(c1C)CCC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)C

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Molecular Weight: 394.52
Empirical Formula: C23H30N4O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.341
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 58
Number of rings: 4

     

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