COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK652851
Chemical Name: 2-(3-acetyl-1H-indol-1-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]ethanone
Smiles: O=C(N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-])Cn1cc(c2c1cccc2)C(=O)C

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Molecular Weight: 406.44
Empirical Formula: C22H22N4O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.648
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 91
Number of rings: 4

     

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