COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL070458
Chemical Name: (2E)-N-(2,4-dimethylpentan-3-yl)-3-(3-nitrophenyl)-2-phenylprop-2-enamide
Smiles: CC(C(C(C)C)NC(=O)/C(=C/c1cccc(c1)[N+](=O)[O-])/c1ccccc1)C

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Molecular Weight: 366.46
Empirical Formula: C22H26N2O3

Physical State: Dry powder
Available Amount: 23 mg

Lipinsky:
logP: 6.149
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 74
Number of rings: 2

     

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