COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL550655
Chemical Name: 3-(4-hydroxy-3-methoxyphenyl)-3-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)-N-[(1S)-1-(1-methyl-1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]propanamide
Smiles: CSCC[C@@H](c1nc2c(n1C)cccc2)NC(=O)CC(c1oc(C)cc(=O)c1O)c1ccc(c(c1)OC)O

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Molecular Weight: 537.64
Empirical Formula: C28H31N3O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.566
Rotatable bonds: 11
H-donors: 3
H-acceptors: 6
PSA: 148
Number of rings: 4

     

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