COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK562213
Chemical Name: (4E)-4-(hydroxy{4-[(2-methylbenzyl)oxy]phenyl}methylidene)-5-(3-methoxyphenyl)-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
Smiles: COc1cccc(c1)C1N(c2nnc(s2)C)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OCc1ccccc1C)/O

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Saltdata: 0,2 CH3COOH
Molecular Weight: 527.6
Empirical Formula: C29H25N3O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.553
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 130
Number of rings: 5

     

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