COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL559239
Chemical Name: 2-hydroxy-3-[2-(3-iodophenyl)-2,3-dihydro-1,5-benzothiazepin-4-yl]-6-methyl-4H-pyran-4-one
Smiles: Ic1cccc(c1)C1Sc2ccccc2N=C(C1)c1c(=O)cc(oc1O)C

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Molecular Weight: 489.33
Empirical Formula: C21H16INO3S

Physical State: Dry powder
Available Amount: 76 mg

Lipinsky:
logP: 3.617
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 84
Number of rings: 4

     

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