COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK153597
Chemical Name: (2Z,5Z)-5-{[1-(4-tert-butylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-[(4-ethoxyphenyl)imino]-1,3-thiazolidin-4-one
Smiles: CCOc1ccc(cc1)/N=C\1/NC(=O)/C(=C/c2cc(n(c2C)c2ccc(cc2)C(C)(C)C)C)/S1

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Molecular Weight: 473.64
Empirical Formula: C28H31N3O2S

Physical State: Dry powder
Available Amount: 467 mg

Lipinsky:
logP: 6.222
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 80
Number of rings: 4

     

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