COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK017424
Chemical Name: 5-bromo-2-{5-[(Z)-{1-[4-(ethoxycarbonyl)phenyl]-3,5-dioxopyrazolidin-4-ylidene}methyl]furan-2-yl}benzoicacid
Smiles: CCOC(=O)c1ccc(cc1)N1NC(=O)/C(=C/c2ccc(o2)c2ccc(cc2C(=O)O)Br)/C1=O

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Molecular Weight: 525.31
Empirical Formula: C24H17BrN2O7

Physical State: Dry powder
Available Amount: 112 mg

Lipinsky:
logP: 5.062
Rotatable bonds: 6
H-donors: 2
H-acceptors: 7
PSA: 126
Number of rings: 4

     

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