COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL416114
Chemical Name: 2-{4-[(E)-2-(4,6-dihydroxy-5-nitropyrimidin-2-yl)ethenyl]phenoxy}-1-(pyrrolidin-1-yl)ethanone
Smiles: O=C(N1CCCC1)COc1ccc(cc1)/C=C/c1nc(O)c(c(n1)O)[N+](=O)[O-]

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Molecular Weight: 386.36
Empirical Formula: C18H18N4O6

Physical State: Dry powder
Available Amount: 204 mg

Lipinsky:
logP: 0.683
Rotatable bonds: 4
H-donors: 2
H-acceptors: 6
PSA: 141
Number of rings: 3

     

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