COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL524767
Chemical Name: 4-hydroxy-3-[2-(4-hydroxy-3-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-yl]-6-methyl-2H-pyran-2-one
Smiles: COc1cc(ccc1O)C1Sc2ccccc2N=C(C1)c1c(O)cc(oc1=O)C

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Molecular Weight: 409.46
Empirical Formula: C22H19NO5S

Physical State: Dry powder
Available Amount: 38 mg

Lipinsky:
logP: 2.436
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 113
Number of rings: 4

     

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