COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK546605
Chemical Name: prop-2-en-1-yl6-[(2-amino-2-oxoethyl)sulfanyl]-4-[4-(benzyloxy)-3-methoxyphenyl]-5-cyano-2-methyl-1,4-dihydropyridine-3-carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1ccc(c(c1)OC)OCc1ccccc1)C#N)SCC(=O)N

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Molecular Weight: 505.59
Empirical Formula: C27H27N3O5S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 3.413
Rotatable bonds: 11
H-donors: 3
H-acceptors: 5
PSA: 148
Number of rings: 3

     

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