COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL161581
Chemical Name: 3-(4-benzylpiperazin-1-yl)-4-({[1-(dimethylamino)cyclohexyl]methyl}amino)cyclobut-3-ene-1,2-dione
Smiles: O=C1C(=O)C(=C1NCC1(CCCCC1)N(C)C)N1CCN(CC1)Cc1ccccc1

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Molecular Weight: 410.56
Empirical Formula: C24H34N4O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.564
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 55
Number of rings: 4

     

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