COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK746529
Chemical Name: 2-amino-4-(3,4,5-trimethoxyphenyl)-4a,5,6,7-tetrahydronaphthalene-1,3,3(4H)-tricarbonitrile
Smiles: N#CC1=C(N)C(C(C2C1=CCCC2)c1cc(OC)c(c(c1)OC)OC)(C#N)C#N

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Molecular Weight: 390.44
Empirical Formula: C22H22N4O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.874
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 125
Number of rings: 3

     

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