COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK109633
Chemical Name: (5Z)-5-[(6-methoxy-1,3-benzodioxol-5-yl)methylidene]-1-(3-methylphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: COc1cc2OCOc2cc1/C=C\1/C(=O)NC(=S)N(C1=O)c1cccc(c1)C

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Molecular Weight: 396.42
Empirical Formula: C20H16N2O5S

Physical State: Dry powder
Available Amount: 294 mg

Lipinsky:
logP: 3.842
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 109
Number of rings: 4

     

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