COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL000473
Chemical Name: 1- methyl- 3- thioxo- 2,3,5,6,7,8- hexahydroisoquinoline- 4- carbonitrile
Smiles: N#Cc1c(=S)[nH]c(c2c1CCCC2)C

Download SD file Download MOL file View 3D-structure Show MSDS

Molecular Weight: 204.3
Empirical Formula: C11H12N2S

Available Amount: 0 mg

Lipinsky:
logP: 2.215
Rotatable bonds: 0
H-donors: 1
H-acceptors: 0
PSA: 67
Number of rings: 2

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