COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL019026
Chemical Name: N-[5-(4-bromobenzyl)-1,3-thiazol-2-yl]-3-methyl-1-oxo-3,4-dihydro-1H-isochromene-3-carboxamide
Smiles: Brc1ccc(cc1)Cc1cnc(s1)NC(=O)C1(C)OC(=O)c2c(C1)cccc2

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Molecular Weight: 457.35
Empirical Formula: C21H17BrN2O3S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 4.89
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 96
Number of rings: 4

     

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