COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL431930
Chemical Name: 3-(5-{(Z)-[1-(3-chlorophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}furan-2-yl)benzoicacid
Smiles: Clc1cccc(c1)N1NC(=O)/C(=C/c2ccc(o2)c2cccc(c2)C(=O)O)/C1=O

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Molecular Weight: 408.8
Empirical Formula: C21H13ClN2O5

Physical State: Dry powder
Available Amount: 56 mg

Lipinsky:
logP: 5.039
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 99
Number of rings: 4

     

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