COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK068928
Chemical Name: ethyl4-{2,5-dimethyl-3-[(Z)-{(2E)-2-[(4-methylphenyl)imino]-4-oxo-1,3-thiazolidin-5-ylidene}methyl]-1H-pyrrol-1-yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1c(C)cc(c1C)/C=C/1\S/C(=N/c2ccc(cc2)C)/NC1=O

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Molecular Weight: 459.57
Empirical Formula: C26H25N3O3S

Physical State: Dry powder
Available Amount: 395 mg

Lipinsky:
logP: 5.152
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 97
Number of rings: 4

     

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