COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL162523
Chemical Name: 3-{[3-(dimethylamino)propyl]amino}-4-{[2-(2-methoxyphenyl)ethyl]amino}cyclobut-3-ene-1,2-dione
Smiles: COc1ccccc1CCNC1=C(C(=O)C1=O)NCCCN(C)C

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Molecular Weight: 331.41
Empirical Formula: C18H25N3O3

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 0.809
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 70
Number of rings: 2

     

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