COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL321933
Chemical Name: diethyl6-amino-5,7,7-tricyano-1,3,7,8a-tetrahydro-1'H,2H-spiro[isoquinoline-8,4'-piperidine]-1',2-dicarboxylate
Smiles: CCOC(=O)N1CCC2(CC1)C1CN(CC=C1C(=C(C2(C#N)C#N)N)C#N)C(=O)OCC

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Molecular Weight: 438.49
Empirical Formula: C22H26N6O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.607
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 156
Number of rings: 3

     

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