COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL151197
Chemical Name: 2-(benzylsulfanyl)-6-hydroxy-4-(3-nitrophenyl)-4,5-dihydropyridine-3-carbonitrile
Smiles: N#CC1=C(SCc2ccccc2)N=C(CC1c1cccc(c1)[N+](=O)[O-])O

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Molecular Weight: 365.41
Empirical Formula: C19H15N3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.829
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 127
Number of rings: 3

     

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