COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL349924
Chemical Name: 3-amino-2-(tetrahydrofuran-2-ylmethyl)-1-thioxo-1,2,5,6,7,8-hexahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(N)n(CC2CCCO2)c(=S)c2c1CCCC2

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Molecular Weight: 289.4
Empirical Formula: C15H19N3OS

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 0.894
Rotatable bonds: 2
H-donors: 2
H-acceptors: 1
PSA: 94
Number of rings: 3

     

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