COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK615750
Chemical Name: 2-(4-acetylphenyl)-3-amino-1-thioxo-1,2,5,6,7,8-hexahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(N)n(c2ccc(cc2)C(=O)C)c(=S)c2c1CCCC2

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Molecular Weight: 323.42
Empirical Formula: C18H17N3OS

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 1.917
Rotatable bonds: 0
H-donors: 2
H-acceptors: 1
PSA: 102
Number of rings: 3

     

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