COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK749166
Chemical Name: 1',2-diacetyl-6-amino-1,2,3,8a-tetrahydro-7H-spiro[isoquinoline-8,4'-piperidine]-5,7,7-tricarbonitrile
Smiles: N#CC1=C(N)C(C2(C3C1=CCN(C3)C(=O)C)CCN(CC2)C(=O)C)(C#N)C#N

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Molecular Weight: 378.43
Empirical Formula: C20H22N6O2

Physical State: Dry powder
Available Amount: 66 mg

Lipinsky:
logP: 0.344
Rotatable bonds: 0
H-donors: 2
H-acceptors: 2
PSA: 138
Number of rings: 3

     

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