COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK000148
Chemical Name: (4Z)-4-(3-bromo-4-hydroxy-5-methoxybenzylidene)-2-(4-chlorophenyl)-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1cc(/C=C/2\C(=O)N(N=C2C(F)(F)F)c2ccc(cc2)Cl)cc(c1O)Br

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Molecular Weight: 475.65
Empirical Formula: C18H11BrClF3N2O3

Available Amount: 0 mg

Lipinsky:
logP: 6.559
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 62
Number of rings: 3

     

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