COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL161575
Chemical Name: 3-{[2-(dimethylamino)ethyl]amino}-4-[(2-methoxybenzyl)amino]cyclobut-3-ene-1,2-dione
Smiles: COc1ccccc1CNC1=C(C(=O)C1=O)NCCN(C)C

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Molecular Weight: 303.36
Empirical Formula: C16H21N3O3

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: 0.494
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 70
Number of rings: 2

     

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