COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL161996
Chemical Name: 3-({[1-(dimethylamino)cyclohexyl]methyl}amino)-4-{[3-(dimethylamino)propyl]amino}cyclobut-3-ene-1,2-dione
Smiles: CN(CCCNC1=C(C(=O)C1=O)NCC1(CCCCC1)N(C)C)C

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Molecular Weight: 336.48
Empirical Formula: C18H32N4O2

Physical State: Dry powder
Available Amount: 223 mg

Lipinsky:
logP: 0.667
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 64
Number of rings: 2

     

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