COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK552131
Chemical Name: 2-methoxyethyl5-cyano-4-(furan-2-yl)-2-methyl-6-({2-[(4-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-1,4-dihydropyridine-3-carboxylate
Smiles: COCCOC(=O)C1=C(C)NC(=C(C1c1ccco1)C#N)SCC(=O)Nc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 498.52
Empirical Formula: C23H22N4O7S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 3.02
Rotatable bonds: 9
H-donors: 2
H-acceptors: 7
PSA: 184
Number of rings: 3

     

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