COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL383214
Chemical Name: butyl5-(5-{(Z)-[1-(3-bromophenyl)-3-hydroxy-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}furan-2-yl)-2-chlorobenzoate
Smiles: CCCCOC(=O)c1cc(ccc1Cl)c1ccc(o1)/C=C\1/C(=NN(C1=O)c1cccc(c1)Br)O

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Molecular Weight: 543.8
Empirical Formula: C25H20BrClN2O5

Physical State: Dry powder
Available Amount: 191 mg

Lipinsky:
logP: 7.197
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 92
Number of rings: 4

     

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