COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL039548
Chemical Name: (5Z)-5-{[(1,3-benzodioxol-5-ylmethyl)amino]methylidene}-1-(4-fluorobenzyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Fc1ccc(cc1)CN1C(=NC(=O)/C(=C/NCc2ccc3c(c2)OCO3)/C1=O)S

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Molecular Weight: 413.43
Empirical Formula: C20H16FN3O4S

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: 3.131
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 119
Number of rings: 4

     

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