COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL507677
Chemical Name: (4Z)-2-(4-chlorophenyl)-4-[4-(dimethylamino)-3-nitrobenzylidene]-5-hydroxy-2,4-dihydro-3H-pyrazol-3-one
Smiles: Clc1ccc(cc1)N1N=C(/C(=C/c2ccc(c(c2)[N+](=O)[O-])N(C)C)/C1=O)O

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Molecular Weight: 386.79
Empirical Formula: C18H15ClN4O4

Physical State: Dry powder
Available Amount: 434 mg

Lipinsky:
logP: 4.24
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 101
Number of rings: 3

     

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