COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL158055
Chemical Name: 3-[4-(3-chlorophenyl)piperazin-1-yl]-4-({2-[(2-hydroxyethyl)amino]ethyl}amino)cyclobut-3-ene-1,2-dione
Smiles: OCCNCCNC1=C(C(=O)C1=O)N1CCN(CC1)c1cccc(c1)Cl

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Molecular Weight: 378.86
Empirical Formula: C18H23ClN4O3

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 0.442
Rotatable bonds: 6
H-donors: 3
H-acceptors: 3
PSA: 84
Number of rings: 3

     

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