COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL507627
Chemical Name: (4Z)-4-[3-bromo-4-(dimethylamino)benzylidene]-2-(3-chlorophenyl)-5-hydroxy-2,4-dihydro-3H-pyrazol-3-one
Smiles: Clc1cccc(c1)N1N=C(/C(=C/c2ccc(c(c2)Br)N(C)C)/C1=O)O

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Molecular Weight: 420.69
Empirical Formula: C18H15BrClN3O2

Physical State: Dry powder
Available Amount: 261 mg

Lipinsky:
logP: 5.478
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 56
Number of rings: 3

     

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