COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK188054
Chemical Name: 2-chloro-5-{2,5-dimethyl-3-[(Z)-(1-methyl-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-1H-pyrrol-1-yl}benzoicacid
Smiles: CN1C(=S)NC(=O)/C(=C/c2cc(n(c2C)c2ccc(c(c2)C(=O)O)Cl)C)/C1=O

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Molecular Weight: 417.87
Empirical Formula: C19H16ClN3O4S

Available Amount: 0 mg

Lipinsky:
logP: 3.106
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 123
Number of rings: 3

     

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