COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK157451
Chemical Name: (5Z)-5-{[1-(4-hydroxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-3-(3-nitrobenzyl)-1,3-thiazolidine-2,4-dione
Smiles: Oc1ccc(cc1)n1c(C)cc(c1C)/C=C/1\SC(=O)N(C1=O)Cc1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 449.49
Empirical Formula: C23H19N3O5S

Physical State: Dry powder
Available Amount: 119 mg

Lipinsky:
logP: 5.007
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 133
Number of rings: 4

     

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