UCSF

ZINC55119619

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2010 28 Yes

Popular Name: (2S)-N-ethyl-2-[1'-[(2R)-2-methylbutyl]-2-oxo-spiro[4H-quinoxaline-3,4'-piperidine]-1-yl]propanamide (2S)-N-ethyl-2-[1'-[(2R)-2-methy…

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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) 2.96 9.71 -44.2 3 6 1 66 387.548 6 ↓
Hi High (pH 8-9.5) 2.96 7.79 -13.39 2 6 0 65 386.54 6 ↓

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

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