COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK838941
Chemical Name: (3E)-4-[5-(3-nitrophenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]pent-3-en-2-one
Smiles: CC(=O)/C=C(/N1N=C(CC1c1cccc(c1)[N+](=O)[O-])c1ccccc1)\C

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Molecular Weight: 349.39
Empirical Formula: C20H19N3O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.452
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 78
Number of rings: 3

     

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