COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL375424
Chemical Name: (5E)-1-(3,4-dichlorophenyl)-5-[(1-methyl-1H-pyrrol-2-yl)methylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: S=C1NC(=O)/C(=C\c2cccn2C)/C(=O)N1c1ccc(c(c1)Cl)Cl

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Molecular Weight: 380.25
Empirical Formula: C16H11Cl2N3O2S

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 3.313
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 86
Number of rings: 3

     

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