COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK562039
Chemical Name: N-{(E)-[1-(4-bromophenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}-3-sulfoalanine
Smiles: OC(=O)C(CS(=O)(=O)O)N/C=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)Br)O

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Molecular Weight: 462.23
Empirical Formula: C14H12BrN3O8S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -0.171
Rotatable bonds: 7
H-donors: 4
H-acceptors: 8
PSA: 182
Number of rings: 2

     

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