COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL416995
Chemical Name: methyl4-(5-{(Z)-[3-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoate
Smiles: COC(=O)c1ccc(cc1)c1ccc(o1)/C=C/1\SC(=S)N(C1=O)N1C(=O)c2c(C1=O)cc(cc2)[N+](=O)[O-]

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Molecular Weight: 535.51
Empirical Formula: C24H13N3O8S2

Physical State: Dry powder
Available Amount: 80 mg

Lipinsky:
logP: 4.428
Rotatable bonds: 3
H-donors: 0
H-acceptors: 8
PSA: 200
Number of rings: 5

     

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