COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK526187
Chemical Name: 6-amino-5,7,7-tricyano-8-(3-methoxyphenyl)-3,7,8,8a-tetrahydroisoquinoline-2(1H)-carboxamide
Smiles: N#CC1=C(N)C(C(C2C1=CCN(C2)C(=O)N)c1cccc(c1)OC)(C#N)C#N

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Molecular Weight: 374.4
Empirical Formula: C20H18N6O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.661
Rotatable bonds: 2
H-donors: 4
H-acceptors: 2
PSA: 152
Number of rings: 3

     

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