COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL334402
Chemical Name: 6-amino-8-[3-ethoxy-4-(propan-2-yloxy)phenyl]-5-methyl-2-propyl-2,3,8,8a-tetrahydroisoquinoline-7,7(1H)-dicarbonitrile
Smiles: CCCN1CC=C2C(C1)C(c1ccc(c(c1)OCC)OC(C)C)C(C(=C2C)N)(C#N)C#N

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Molecular Weight: 434.58
Empirical Formula: C26H34N4O2

Physical State: Dry powder
Available Amount: 62 mg

Lipinsky:
logP: 4.42
Rotatable bonds: 7
H-donors: 2
H-acceptors: 2
PSA: 95
Number of rings: 3

     

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