COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL371835
Chemical Name: (5E)-5-[(2,5-dimethyl-1H-pyrrol-3-yl)methylidene]-1-(3-methoxyphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: COc1cccc(c1)N1C(=S)NC(=O)/C(=C\c2cc([nH]c2C)C)/C1=O

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Molecular Weight: 355.42
Empirical Formula: C18H17N3O3S

Physical State: Dry powder
Available Amount: 124 mg

Lipinsky:
logP: 2.623
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 106
Number of rings: 3

     

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