COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK206845
Chemical Name: (4E)-4-(3-chlorobenzylidene)-2-(4-nitrophenyl)-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CCCC1=NN(C(=O)/C/1=C/c1cccc(c1)Cl)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 369.81
Empirical Formula: C19H16ClN3O3

Physical State: Dry powder
Available Amount: 175 mg

Lipinsky:
logP: 4.711
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 78
Number of rings: 3

     

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