COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK646814
Chemical Name: methyl{[4-(4-bromophenyl)-3-cyano-6-hydroxy-4,5-dihydropyridin-2-yl]sulfanyl}acetate
Smiles: COC(=O)CSC1=C(C#N)C(CC(=N1)O)c1ccc(cc1)Br

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Molecular Weight: 381.25
Empirical Formula: C15H13BrN2O3S

Physical State: Dry powder
Available Amount: 156 mg

Lipinsky:
logP: 3.513
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 107
Number of rings: 2

     

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