COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL551460
Chemical Name: (2S,6'R)-7-chloro-4,6-dimethoxy-6'-methyl-4'-[(5-methyl-6-oxo-5,6-dihydropyrido[2,3-b][1,4]benzothiazepin-8-yl)amino]-2'H,3H-spiro[1-benzofuran-2,1'-cyclohex[3]ene]-2',3-dione
Smiles: COc1cc(OC)c(c2c1C(=O)[C@]1(O2)[C@H](C)CC(=CC1=O)Nc1ccc2c(c1)C(=O)N(C)c1c(S2)nccc1)Cl

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Molecular Weight: 578.04
Empirical Formula: C29H24ClN3O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.686
Rotatable bonds: 2
H-donors: 1
H-acceptors: 6
PSA: 132
Number of rings: 6

     

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