COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL059050
Chemical Name: 2,6-dioxo-5-[(E)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-1,2,5,6-tetrahydropyrimidin-4-olate
Smiles: O=C1NC(=O)N=C(C1/C=C/1\C=CC=CC1=O)[O-]

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Saltdata: NH4+
Molecular Weight: 231.19
Empirical Formula: C11H7N2O4

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: -0.813
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 98
Number of rings: 2

     

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