COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL372381
Chemical Name: 5-{[(1,3-benzodioxol-5-ylmethyl)amino]methylidene}-1,3-dimethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: S=C1N(C)C(=O)C(=CNCc2ccc3c(c2)OCO3)C(=O)N1C

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Molecular Weight: 333.37
Empirical Formula: C15H15N3O4S

Physical State: Dry powder
Available Amount: 327 mg

Lipinsky:
logP: 0.566
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 103
Number of rings: 3

     

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