COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL381272
Chemical Name: 2-chloro-5-{5-[(E)-{3-[2-(4-nitrophenyl)-2-oxoethyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl]furan-2-yl}benzoicacid
Smiles: O=C1S/C(=C/c2ccc(o2)c2ccc(c(c2)C(=O)O)Cl)/C(=O)N1CC(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 512.88
Empirical Formula: C23H13ClN2O8S

Physical State: Dry powder
Available Amount: 808 mg

Lipinsky:
logP: 5.178
Rotatable bonds: 6
H-donors: 1
H-acceptors: 8
PSA: 176
Number of rings: 4

     

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