COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK050201
Chemical Name: 2-amino-5-(4-butoxy-3-methoxyphenyl)-4a,5,6,7-tetrahydronaphthalene-1,3,3(4H)-tricarbonitrile
Smiles: CCCCOc1ccc(cc1OC)C1CCC=C2C1CC(C#N)(C#N)C(=C2C#N)N

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Molecular Weight: 402.5
Empirical Formula: C24H26N4O2

Physical State: Dry powder
Available Amount: 395 mg

Lipinsky:
logP: 4.319
Rotatable bonds: 6
H-donors: 2
H-acceptors: 2
PSA: 115
Number of rings: 3

     

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