COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK195468
Chemical Name: (5E)-5-[(6-chloro-1,3-benzodioxol-5-yl)methylidene]-1-(2,3-dichlorophenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: O=C1NC(=S)N(C(=O)/C/1=C/c1cc2OCOc2cc1Cl)c1cccc(c1Cl)Cl

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Molecular Weight: 455.7
Empirical Formula: C18H9Cl3N2O4S

Physical State: Dry powder
Available Amount: 175 mg

Lipinsky:
logP: 4.954
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 99
Number of rings: 4

     

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