COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL565067
Chemical Name: (1S,5R)-3-(3-phenylprop-2-yn-1-yl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Smiles: O=c1cccc2n1C[C@H]1CN(C[C@@H]2C1)CC#Cc1ccccc1

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Saltdata: (COOH)2
Molecular Weight: 304.39
Empirical Formula: C20H20N2O

Available Amount: 0 mg

Lipinsky:
logP: 3.545
Rotatable bonds: 1
H-donors: 0
H-acceptors: 1
PSA: 23
Number of rings: 4

     

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