COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL431984
Chemical Name: 5-{(4Z)-4-[4-(dimethylamino)benzylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzene-1,3-dicarboxylicacid
Smiles: CC1=NN(C(=O)/C/1=C\c1ccc(cc1)N(C)C)c1cc(cc(c1)C(=O)O)C(=O)O

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Molecular Weight: 393.4
Empirical Formula: C21H19N3O5

Physical State: Dry powder
Available Amount: 95 mg

Lipinsky:
logP: 3.261
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 110
Number of rings: 3

     

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