COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL171861
Chemical Name: ethyl4-{[(2-bromo-4-{(Z)-[1-(3,4-dichlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-6-ethoxyphenoxy)acetyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)COc1c(Br)cc(cc1OCC)/C=C\1/C(=NN(C1=O)c1ccc(c(c1)Cl)Cl)C

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Molecular Weight: 675.36
Empirical Formula: C30H26BrCl2N3O6

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 7.324
Rotatable bonds: 8
H-donors: 1
H-acceptors: 6
PSA: 106
Number of rings: 4

     

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