COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK550575
Chemical Name: prop-2-en-1-yl5-cyano-6-{[2-(diphenylamino)-2-oxoethyl]sulfanyl}-4-(4-hydroxy-3-methoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1ccc(c(c1)OC)O)C#N)SCC(=O)N(c1ccccc1)c1ccccc1

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Molecular Weight: 567.67
Empirical Formula: C32H29N3O5S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 4.273
Rotatable bonds: 10
H-donors: 2
H-acceptors: 5
PSA: 137
Number of rings: 4

     

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