COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL323822
Chemical Name: 3-[2-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)-2,3-dihydro-1,5-benzothiazepin-4-yl]-4-hydroxy-6-methyl-2H-pyran-2-one
Smiles: COc1ccc(cc1OC)C1Sc2ccc(cc2N=C(C1)c1c(O)cc(oc1=O)C)C(F)(F)F

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Molecular Weight: 491.49
Empirical Formula: C24H20F3NO5S

Available Amount: 0 mg

Lipinsky:
logP: 3.777
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 102
Number of rings: 4

     

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