COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK958067
Chemical Name: 6-amino-8-(2,4-dimethoxyphenyl)-2-(propan-2-yl)-2,3,8,8a-tetrahydroisoquinoline-5,5,7(1H)-tricarbonitrile
Smiles: N#CC1=C(N)C(C2=CCN(CC2C1c1ccc(cc1OC)OC)C(C)C)(C#N)C#N

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Molecular Weight: 403.48
Empirical Formula: C23H25N5O2

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.49
Rotatable bonds: 4
H-donors: 2
H-acceptors: 2
PSA: 119
Number of rings: 3

     

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