UCSF

ZINC61441766

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2011 19 Yes

Popular Name: 1-[2-(4-pyridyl)ethyl]-3,4-dihydroquinoxalin-2-one 1-[2-(4-pyridyl)ethyl]-3,4-dihyd…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.55 5.79 -8.82 1 4 0 45 253.305 3 ↓
Lo Low (pH 4.5-6) 1.55 6.25 -37.03 2 4 1 46 254.313 3 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.