COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK544530
Chemical Name: 3-(4-benzylpiperidin-1-yl)-1-[5-(3-nitrophenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]propan-1-one
Smiles: O=C(N1N=C(CC1c1cccc(c1)[N+](=O)[O-])c1ccccc1)CCN1CCC(CC1)Cc1ccccc1

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Molecular Weight: 496.61
Empirical Formula: C30H32N4O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.789
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 81
Number of rings: 5

     

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