COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK865000
Chemical Name: N-[5-(4-bromobenzyl)-1,3-thiazol-2-yl]-1-oxo-1H-isothiochromene-3-carboxamide
Smiles: Brc1ccc(cc1)Cc1cnc(s1)NC(=O)c1cc2ccccc2c(=O)s1

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Molecular Weight: 457.37
Empirical Formula: C20H13BrN2O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.517
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 112
Number of rings: 4

     

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