COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL407883
Chemical Name: 3-[(1,3-benzodioxol-5-ylmethyl)amino]-4-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]amino}cyclobut-3-ene-1,2-dione
Smiles: O=C(N1CCCC1)CNC1=C(C(=O)C1=O)NCc1ccc2c(c1)OCO2

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Molecular Weight: 357.37
Empirical Formula: C18H19N3O5

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 0.843
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 96
Number of rings: 4

     

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