COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL233534
Chemical Name: (5-bromo-1H-indol-3-yl)(4-{2-[(3-fluorophenyl)amino]-2-oxoethyl}piperazin-1-yl)aceticacid
Smiles: O=C(Nc1cccc(c1)F)CN1CCN(CC1)C(c1c[nH]c2c1cc(Br)cc2)C(=O)O

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Molecular Weight: 489.34
Empirical Formula: C22H22BrFN4O3

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 4.001
Rotatable bonds: 4
H-donors: 3
H-acceptors: 3
PSA: 88
Number of rings: 4

     

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