COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL533432
Chemical Name: 4-butyl-7-methyl-2-oxo-2H-chromen-5-ylN-[(4-methylphenyl)sulfonyl]-L-isoleucinate
Smiles: CCCCc1cc(=O)oc2c1c(OC(=O)[C@H]([C@@H](CC)C)NS(=O)(=O)c1ccc(cc1)C)cc(c2)C

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Molecular Weight: 499.63
Empirical Formula: C27H33NO6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.928
Rotatable bonds: 8
H-donors: 1
H-acceptors: 6
PSA: 107
Number of rings: 3

     

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