COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK856598
Chemical Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-4-oxo-4H-chromen-7-ylthiophene-2-carboxylate
Smiles: CCc1cc2c(cc1OC(=O)c1cccs1)occ(c2=O)c1ccc2c(c1)OCCCO2

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Molecular Weight: 448.5
Empirical Formula: C25H20O6S

Physical State: Dry powder
Available Amount: 389 mg

Lipinsky:
logP: 5.689
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 99
Number of rings: 5

     

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