COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK387312
Chemical Name: 4,4-dimethyl-2-oxo-6-(prop-2-en-1-ylsulfanyl)-1,2,3,4-tetrahydropyridine-3,5-dicarbonitrile
Smiles: C=CCSC1=C(C#N)C(C(C(=O)N1)C#N)(C)C

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Molecular Weight: 247.32
Empirical Formula: C12H13N3OS

Physical State: Dry powder
Available Amount: 126 mg

Lipinsky:
logP: 2.347
Rotatable bonds: 3
H-donors: 1
H-acceptors: 1
PSA: 101
Number of rings: 1

     

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