COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK198960
Chemical Name: 2-chloro-5-(3-{(E)-[1-(2,4-dimethoxyphenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-2,5-dimethyl-1H-pyrrol-1-yl)benzoicacid
Smiles: COc1ccc(c(c1)OC)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: 540
Empirical Formula: C26H22ClN3O6S

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 4.57
Rotatable bonds: 5
H-donors: 2
H-acceptors: 6
PSA: 142
Number of rings: 4

     

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