COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK393937
Chemical Name: (2E,5E)-2-[(4-ethoxyphenyl)imino]-5-{[1-(3-nitrophenyl)-1H-pyrrol-2-yl]methylidene}-1,3-thiazolidin-4-one
Smiles: CCOc1ccc(cc1)/N=C\1/S/C(=C/c2cccn2c2cccc(c2)[N+](=O)[O-])/C(=O)N1

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Molecular Weight: 434.48
Empirical Formula: C22H18N4O4S

Physical State: Dry powder
Available Amount: 259 mg

Lipinsky:
logP: 3.343
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 126
Number of rings: 4

     

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