COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL158473
Chemical Name: 3-[(1,3-benzodioxol-5-ylmethyl)amino]-4-[(furan-2-ylmethyl)amino]cyclobut-3-ene-1,2-dione
Smiles: O=C1C(=O)C(=C1NCc1ccco1)NCc1ccc2c(c1)OCO2

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Molecular Weight: 326.31
Empirical Formula: C17H14N2O5

Physical State: Dry powder
Available Amount: 313 mg

Lipinsky:
logP: 1.258
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 89
Number of rings: 4

     

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