COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL040672
Chemical Name: (5E)-5-{[(2-ammoniocyclohexyl)amino]methylidene}-1-(4-methoxyphenyl)-4,6-dioxo-1,4,5,6-tetrahydropyrimidine-2-thiolate
Smiles: COc1ccc(cc1)N1C(=NC(=O)/C(=C\NC2CCCCC2[NH3+])/C1=O)[S-]

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Molecular Weight: 374.46
Empirical Formula: C18H22N4O3S

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: 1.714
Rotatable bonds: 1
H-donors: 4
H-acceptors: 3
PSA: 98
Number of rings: 3

     

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