COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL157282
Chemical Name: 3-[(3,4-dimethoxybenzyl)amino]-4-{[2-(dimethylamino)ethyl]amino}cyclobut-3-ene-1,2-dione
Smiles: COc1cc(CNC2=C(C(=O)C2=O)NCCN(C)C)ccc1OC

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Molecular Weight: 333.39
Empirical Formula: C17H23N3O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.316
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 79
Number of rings: 2

     

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