COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK676825
Chemical Name: 6-amino-2-benzyl-8-(naphthalen-1-yl)-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Smiles: N#CC1=C(N)C(C(C2C1=CCN(C2)Cc1ccccc1)c1cccc2c1cccc2)(C#N)C#N

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Molecular Weight: 441.54
Empirical Formula: C29H23N5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.048
Rotatable bonds: 2
H-donors: 2
H-acceptors: 0
PSA: 100
Number of rings: 5

     

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