COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL559787
Chemical Name: 2-hydroxy-3-{2-[2-hydroxy-3-(prop-2-en-1-yl)phenyl]-7-(trifluoromethyl)-2,3-dihydro-1,5-benzothiazepin-4-yl}-6-methyl-4H-pyran-4-one
Smiles: C=CCc1cccc(c1O)C1Sc2ccc(cc2N=C(C1)c1c(=O)cc(oc1O)C)C(F)(F)F

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Molecular Weight: 487.5
Empirical Formula: C25H20F3NO4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.438
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 104
Number of rings: 4

     

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