COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK614055
Chemical Name: methyl2-[({6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-4-(furan-2-yl)-2-methyl-1,4-dihydropyridin-3-yl}carbonyl)amino]benzoate
Smiles: COC(=O)c1ccccc1NC(=O)C1=C(C)NC(=C(C1c1ccco1)C#N)SCC(=O)N

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Molecular Weight: 452.49
Empirical Formula: C22H20N4O5S

Physical State: Dry powder
Available Amount: 343 mg

Lipinsky:
logP: 3.083
Rotatable bonds: 7
H-donors: 4
H-acceptors: 5
PSA: 172
Number of rings: 3

     

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