COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK808399
Chemical Name: N-[2,2,2-trichloro-1-(3-nitrophenoxy)ethyl]butanamide
Smiles: CCCC(=O)NC(C(Cl)(Cl)Cl)Oc1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 355.6
Empirical Formula: C12H13Cl3N2O4

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 4.187
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 84
Number of rings: 1

     

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