COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK586551
Chemical Name: 2-{[3-cyano-6-hydroxy-4-(2-methylphenyl)-4,5-dihydropyridin-2-yl]sulfanyl}-N-(4-nitrophenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)[N+](=O)[O-])N=C(CC1c1ccccc1C)O

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Molecular Weight: 422.46
Empirical Formula: C21H18N4O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.684
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 156
Number of rings: 3

     

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