COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL333558
Chemical Name: 6-amino-2-ethyl-8-(2-methoxynaphthalen-1-yl)-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Smiles: CCN1CC=C2C(C1)C(c1c(OC)ccc3c1cccc3)C(C(=C2C#N)N)(C#N)C#N

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Molecular Weight: 409.49
Empirical Formula: C25H23N5O

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.03
Rotatable bonds: 3
H-donors: 2
H-acceptors: 1
PSA: 109
Number of rings: 4

     

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