COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK533295
Chemical Name: (1R,8aS)-4-amino-1-(4-ethoxyphenyl)-6,7,8,8a-tetrahydronaphthalene-2,2,3(1H)-tricarbonitrile
Smiles: CCOc1ccc(cc1)[C@H]1[C@@H]2CCCC=C2C(=C(C1(C#N)C#N)C#N)N

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Molecular Weight: 344.42
Empirical Formula: C21H20N4O

Physical State: Dry powder
Available Amount: 272 mg

Lipinsky:
logP: 3.92
Rotatable bonds: 1
H-donors: 2
H-acceptors: 1
PSA: 106
Number of rings: 3

     

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