COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL315827
Chemical Name: 4-[5-hydroxy-1-(3-methoxyphenyl)-6,8-dihydro-1H-imidazo[4,5-e][1,4]thiazepin-8-yl]benzoicacid
Smiles: COc1cccc(c1)n1cnc2c1C(SCC(=N2)O)c1ccc(cc1)C(=O)O

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Molecular Weight: 395.44
Empirical Formula: C20H17N3O4S

Physical State: Dry powder
Available Amount: 317 mg

Lipinsky:
logP: 3.663
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 122
Number of rings: 4

     

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