COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL559930
Chemical Name: (E)-N~3~-{[1-benzyl-4-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)piperidin-4-yl]acetyl}-N-(4-methyl-1,3-thiazol-2(3H)-ylidene)-beta-alaninamide
Smiles: O=C(CC1(CCN(CC1)Cc1ccccc1)c1oc(C)cc(=O)c1O)NCCC(=O)/N=c\1/scc([nH]1)C

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Molecular Weight: 524.64
Empirical Formula: C27H32N4O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.976
Rotatable bonds: 7
H-donors: 3
H-acceptors: 5
PSA: 145
Number of rings: 4

     

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