COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL344045
Chemical Name: 3-amino-7-benzyl-2-methyl-1-thioxo-1,2,5,6,7,8-hexahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c2CCC(Cc2c(=S)n(c1N)C)Cc1ccccc1

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Molecular Weight: 309.44
Empirical Formula: C18H19N3S

Physical State: Dry powder
Available Amount: 59 mg

Lipinsky:
logP: 2.689
Rotatable bonds: 1
H-donors: 2
H-acceptors: 0
PSA: 85
Number of rings: 3

     

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