COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL026805
Chemical Name: 2-[(E)-2-(1-hexyl-1H-indol-3-yl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one
Smiles: CCCCCCn1cc(c2c1cccc2)/C=C/c1nc(O)c(c(=O)[nH]1)[N+](=O)[O-]

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Molecular Weight: 382.42
Empirical Formula: C20H22N4O4

Available Amount: 0 mg

Lipinsky:
logP: 3.467
Rotatable bonds: 8
H-donors: 2
H-acceptors: 4
PSA: 112
Number of rings: 3

     

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