COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK674096
Chemical Name: 6-amino-2-(2,2-dimethylpropanoyl)-8-(thiophen-3-yl)-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Smiles: N#CC1=C(N)C(C(C2C1=CCN(C2)C(=O)C(C)(C)C)c1ccsc1)(C#N)C#N

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Molecular Weight: 391.5
Empirical Formula: C21H21N5OS

Physical State: Dry powder
Available Amount: 6 mg

Lipinsky:
logP: 2.895
Rotatable bonds: 1
H-donors: 2
H-acceptors: 1
PSA: 145
Number of rings: 3

     

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