COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK670996
Chemical Name: dicyano[(4S,5R,6R)-3-cyano-4-(4-fluorophenyl)-6-hydroxy-6-methyl-5-(pyridinium-1-yl)-1,4,5,6-tetrahydropyridin-2-yl]methanide
Smiles: N#C[C-](C1=C(C#N)[C@@H]([C@H]([C@@](N1)(C)O)[n+]1ccccc1)c1ccc(cc1)F)C#N

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Molecular Weight: 373.39
Empirical Formula: C21H16FN5O

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 0
Rotatable bonds: 0
H-donors: 2
H-acceptors: 1
PSA: 107
Number of rings: 3

     

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