COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK832542
Chemical Name: N-[1,1,1-trichloro-4-(4-nitrophenyl)-4-oxobutan-2-yl]acetamide
Smiles: CC(=O)NC(C(Cl)(Cl)Cl)CC(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 353.59
Empirical Formula: C12H11Cl3N2O4

Physical State: Dry powder
Available Amount: 216 mg

Lipinsky:
logP: 2.833
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 91
Number of rings: 1

     

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