COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK933968
Chemical Name: [5-bromo-1-(carboxymethyl)-1H-indol-3-yl][4-(2-cyanoethyl)piperazin-1-yl]aceticacid
Smiles: N#CCCN1CCN(CC1)C(c1cn(c2c1cc(Br)cc2)CC(=O)O)C(=O)O

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Molecular Weight: 449.3
Empirical Formula: C19H21BrN4O4

Physical State: Dry powder
Available Amount: 325 mg

Lipinsky:
logP: 1.317
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 109
Number of rings: 3

     

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