COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL439473
Chemical Name: 3-methyl-N-[4-(morpholin-4-yl)phenyl]-5-oxo-4-[4-(trifluoromethyl)benzyl]-2,3,4,5-tetrahydro-1,4-benzothiazepine-3-carboxamide
Smiles: O=C1c2ccccc2SCC(N1Cc1ccc(cc1)C(F)(F)F)(C)C(=O)Nc1ccc(cc1)N1CCOCC1

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Molecular Weight: 555.62
Empirical Formula: C29H28F3N3O3S

Available Amount: 0 mg

Lipinsky:
logP: 3.71
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 87
Number of rings: 5

     

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