COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK623791
Chemical Name: 3-amino-2-(3-methoxypropyl)-1-thioxo-1,2,5,6,7,8-hexahydroisoquinoline-4-carbonitrile
Smiles: COCCCn1c(N)c(C#N)c2c(c1=S)CCCC2

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Molecular Weight: 277.39
Empirical Formula: C14H19N3OS

Physical State: Dry powder
Available Amount: 313 mg

Lipinsky:
logP: 0.945
Rotatable bonds: 4
H-donors: 2
H-acceptors: 1
PSA: 94
Number of rings: 2

     

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