COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL023852
Chemical Name: 4-{2-[(1,3-diethyl-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-1H-pyrrol-1-yl}benzoicacid
Smiles: CCN1C(=O)C(=Cc2cccn2c2ccc(cc2)C(=O)O)C(=O)N(C1=S)CC

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Molecular Weight: 397.45
Empirical Formula: C20H19N3O4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.867
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 114
Number of rings: 3

     

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