COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL152922
Chemical Name: 3-{[3-(dimethylamino)propyl]amino}-4-{[2-(4-hydroxyphenyl)ethyl]amino}cyclobut-3-ene-1,2-dione
Smiles: CN(CCCNC1=C(C(=O)C1=O)NCCc1ccc(cc1)O)C

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Molecular Weight: 317.39
Empirical Formula: C17H23N3O3

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 0.157
Rotatable bonds: 6
H-donors: 3
H-acceptors: 3
PSA: 81
Number of rings: 2

     

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