COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK667980
Chemical Name: dicyano[3-cyano-6-cyclopropyl-6-hydroxy-5-(2-methylpyridinium-1-yl)-4-(4-nitrophenyl)-1,4,5,6-tetrahydropyridin-2-yl]methanide
Smiles: N#C[C-](C1=C(C#N)C(C(C(N1)(O)C1CC1)[n+]1ccccc1C)c1ccc(cc1)[N+](=O)[O-])C#N

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Molecular Weight: 440.46
Empirical Formula: C24H20N6O3

Physical State: Dry powder
Available Amount: 68 mg

Lipinsky:
logP: 0
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 153
Number of rings: 4

     

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