COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL371778
Chemical Name: (5E)-5-{[(1,3-benzodioxol-5-ylmethyl)amino]methylidene}-1-(2-fluorophenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: O=C1NC(=S)N(C(=O)/C/1=C/NCc1ccc2c(c1)OCO2)c1ccccc1F

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Molecular Weight: 399.4
Empirical Formula: C19H14FN3O4S

Physical State: Dry powder
Available Amount: 438 mg

Lipinsky:
logP: 2.608
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 111
Number of rings: 4

     

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