COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL058907
Chemical Name: 5'-acetyl-3'-cyano-6'-methyl-1',2',3',4'-tetrahydro-3,4'-bipyridine-2'-thiolate
Smiles: N#CC1C([S-])NC(=C(C1c1cccnc1)C(=O)C)C

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Saltdata: cyClo-(N+(CH2)2O(CH2)2)
Molecular Weight: 272.35
Empirical Formula: C14H14N3OS

Physical State: Dry powder
Available Amount: 292 mg

Lipinsky:
logP: 1.103
Rotatable bonds: 2
H-donors: 1
H-acceptors: 1
PSA: 65
Number of rings: 2

     

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