COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL408376
Chemical Name: 3-[(1,3-benzodioxol-5-ylmethyl)amino]-4-[(4-chlorobenzyl)amino]cyclobut-3-ene-1,2-dione
Smiles: Clc1ccc(cc1)CNC1=C(C(=O)C1=O)NCc1ccc2c(c1)OCO2

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Molecular Weight: 370.79
Empirical Formula: C19H15ClN2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.691
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 76
Number of rings: 4

     

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