COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL409354
Chemical Name: 1-(4-bromophenyl)-8-(3-hydroxy-4-methoxyphenyl)-6,8-dihydro-1H-imidazo[4,5-e][1,4]thiazepin-5-ol
Smiles: COc1ccc(cc1O)C1SCC(=Nc2c1n(cn2)c1ccc(cc1)Br)O

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Molecular Weight: 446.32
Empirical Formula: C19H16BrN3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.812
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 105
Number of rings: 4

     

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