COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK566439
Chemical Name: 4-(2-{[(E)-(6-hydroxy-4-oxo-2-sulfanylpyrimidin-5(4H)-ylidene)methyl]amino}ethyl)-N-methylpiperazine-1-carbothioamide
Smiles: CNC(=S)N1CCN(CC1)CCN/C=C/1\C(=NC(=NC1=O)S)O

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Molecular Weight: 356.47
Empirical Formula: C13H20N6O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -0.61
Rotatable bonds: 4
H-donors: 3
H-acceptors: 2
PSA: 163
Number of rings: 2

     

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