COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK391905
Chemical Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(4-nitrophenyl)piperazin-1-yl]pyrrolidine-2,5-dione
Smiles: COc1ccc(cc1OC)CCN1C(=O)CC(C1=O)N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 468.51
Empirical Formula: C24H28N4O6

Physical State: Dry powder
Available Amount: 59 mg

Lipinsky:
logP: 3.273
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 108
Number of rings: 4

     

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