COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK196844
Chemical Name: (5E)-1-(2,3-dichlorophenyl)-5-[(1-phenyl-1H-pyrrol-2-yl)methylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: O=C1NC(=S)N(C(=O)/C/1=C/c1cccn1c1ccccc1)c1cccc(c1Cl)Cl

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Molecular Weight: 442.32
Empirical Formula: C21H13Cl2N3O2S

Physical State: Dry powder
Available Amount: 172 mg

Lipinsky:
logP: 5.183
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 86
Number of rings: 4

     

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