COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL525040
Chemical Name: 4-hydroxy-3-[2-(3-hydroxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4-yl]-6-methyl-2H-pyran-2-one
Smiles: Oc1cccc(c1)C1Sc2ccccc2N=C(C1)c1c(O)cc(oc1=O)C

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Molecular Weight: 379.44
Empirical Formula: C21H17NO4S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 2.732
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 104
Number of rings: 4

     

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