COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK188021
Chemical Name: 2-chloro-5-(3-{(E)-[1-(4-ethylphenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-2,5-dimethyl-1H-pyrrol-1-yl)benzoicacid
Smiles: CCc1ccc(cc1)N1C(=S)NC(=O)/C(=C\c2cc(n(c2C)c2ccc(c(c2)C(=O)O)Cl)C)/C1=O

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Molecular Weight: 508
Empirical Formula: C26H22ClN3O4S

Physical State: Dry powder
Available Amount: 144 mg

Lipinsky:
logP: 5.85
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 123
Number of rings: 4

     

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