COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL005011
Chemical Name: (5E)-5-{[(1-benzylpiperidin-4-yl)amino]methylidene}-1-butyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCCCN1C(=S)NC(=O)/C(=C\NC2CCN(CC2)Cc2ccccc2)/C1=O

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Molecular Weight: 400.55
Empirical Formula: C21H28N4O2S

Available Amount: 0 mg

Lipinsky:
logP: 2.677
Rotatable bonds: 4
H-donors: 2
H-acceptors: 2
PSA: 96
Number of rings: 3

     

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