COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL352950
Chemical Name: 2-{[(E)-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Smiles: COc1cc2CN(CCc2cc1OC)/C=N/c1sc2c(c1C#N)CCCC2

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Molecular Weight: 381.5
Empirical Formula: C21H23N3O2S

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 4.508
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 86
Number of rings: 4

     

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