COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK673080
Chemical Name: (8S,8aS)-6-amino-7,7-dicyano-8-(furan-2-yl)-2-methyl-1,2,3,7,8,8a-hexahydroisoquinoline-5-carboxylicacid
Smiles: N#CC1(C#N)[C@@H](c2ccco2)[C@@H]2CN(C)CC=C2C(=C1N)C(=O)O

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Molecular Weight: 324.34
Empirical Formula: C17H16N4O3

Physical State: Dry powder
Available Amount: 2 mg

Lipinsky:
logP: 1.604
Rotatable bonds: 2
H-donors: 3
H-acceptors: 3
PSA: 127
Number of rings: 3

     

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