COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK700570
Chemical Name: methyl4-{(E)-[1-(4-nitrophenyl)-5-oxo-3-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}benzoate
Smiles: COC(=O)c1ccc(cc1)/C=C\1/C(=O)N(N=C1c1ccccc1)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 427.42
Empirical Formula: C24H17N3O5

Physical State: Dry powder
Available Amount: 262 mg

Lipinsky:
logP: 4.088
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 104
Number of rings: 4

     

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