COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK754126
Chemical Name: ethyl(2R,3R,4R)-5-cyano-6-{[2-(cyclopropylamino)-2-oxoethyl]sulfanyl}-2-hydroxy-2-methyl-4-(thiophen-2-yl)-1,2,3,4-tetrahydropyridine-3-carboxylate
Smiles: CCOC(=O)[C@@H]1[C@@H](c2cccs2)C(=C(N[C@]1(C)O)SCC(=O)NC1CC1)C#N

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Molecular Weight: 421.54
Empirical Formula: C19H23N3O4S2

Physical State: Dry powder
Available Amount: 7 mg

Lipinsky:
logP: 3.301
Rotatable bonds: 6
H-donors: 3
H-acceptors: 4
PSA: 164
Number of rings: 3

     

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