COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK901031
Chemical Name: dimethyl2-({[5-(4-bromophenyl)-1H-pyrazol-3-yl]carbonyl}amino)benzene-1,4-dicarboxylate
Smiles: COC(=O)c1ccc(cc1NC(=O)c1n[nH]c(c1)c1ccc(cc1)Br)C(=O)OC

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Molecular Weight: 458.27
Empirical Formula: C20H16BrN3O5

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 5.782
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 110
Number of rings: 3

     

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