COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK678987
Chemical Name: ethyl4-(1,3-benzothiazol-2-ylcarbonyl)-1-(4-bromophenyl)-1H-pyrazole-3-carboxylate
Smiles: CCOC(=O)c1nn(cc1C(=O)c1nc2c(s1)cccc2)c1ccc(cc1)Br

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Molecular Weight: 456.32
Empirical Formula: C20H14BrN3O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.622
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 102
Number of rings: 4

     

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