COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK657147
Chemical Name: [5-bromo-1-(carboxymethyl)-1H-indol-3-yl][4-(2-methylprop-2-en-1-yl)piperazin-1-yl]aceticacid
Smiles: CC(=C)CN1CCN(CC1)C(c1cn(c2c1cc(Br)cc2)CC(=O)O)C(=O)O

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Molecular Weight: 450.33
Empirical Formula: C20H24BrN3O4

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 3.014
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 86
Number of rings: 3

     

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