COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK125002
Chemical Name: 4-(5-{(Z)-[1-(3,4-dichlorophenyl)-5-oxo-3-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}furan-2-yl)benzenesulfonicacid
Smiles: O=C1/C(=C\c2ccc(o2)c2ccc(cc2)S(=O)(=O)O)/C(=NN1c1ccc(c(c1)Cl)Cl)c1ccccc1

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Molecular Weight: 539.39
Empirical Formula: C26H16Cl2N2O5S

Physical State: Dry powder
Available Amount: 272 mg

Lipinsky:
logP: 5.017
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 108
Number of rings: 5

     

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