COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK724588
Chemical Name: 6-amino-2-methyl-8-[4-(prop-2-en-1-yloxy)phenyl]-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Smiles: C=CCOc1ccc(cc1)C1C2CN(C)CC=C2C(=C(C1(C#N)C#N)N)C#N

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Molecular Weight: 371.44
Empirical Formula: C22H21N5O

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.073
Rotatable bonds: 2
H-donors: 2
H-acceptors: 1
PSA: 109
Number of rings: 3

     

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