COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK465866
Chemical Name: (2E)-3-[3-(4-bromophenyl)-1H-pyrazol-4-yl]-2-cyano-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]prop-2-enamide
Smiles: N#C/C(=C\c1c[nH]nc1c1ccc(cc1)Br)/C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nccs1

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Molecular Weight: 555.44
Empirical Formula: C22H15BrN6O3S2

Physical State: Dry powder
Available Amount: 169 mg

Lipinsky:
logP: 4.088
Rotatable bonds: 2
H-donors: 3
H-acceptors: 3
PSA: 177
Number of rings: 4

     

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