COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL295757
Chemical Name: methyl5-({(E)-[1-(4-bromo-2,3-dimethylphenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-2-chlorobenzoate
Smiles: COC(=O)c1cc(N/C=C/2\C(=NN(C2=O)c2ccc(c(c2C)C)Br)C)ccc1Cl

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Molecular Weight: 476.76
Empirical Formula: C21H19BrClN3O3

Physical State: Dry powder
Available Amount: 228 mg

Lipinsky:
logP: 4.913
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 71
Number of rings: 3

     

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