UCSF

ZINC33815259

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 20th, 2009 30 Yes

Popular Name: 7-(5,8-diazaspiro[3.5]nonan-8-yl)-6-fluoro-1-[(1R,2S)-2-fluorocyclopropyl]-8-methoxy-4-oxo-quinoline 7-(5,8-diazaspiro[3.5]nonan-8-yl…

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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) 0.39 10.02 -102.55 2 7 0 91 419.428 4 ↓
Hi High (pH 8-9.5) 0.39 8.86 -66.93 1 7 -1 87 418.42 4 ↓
Mid Mid (pH 6-8) 0.39 8.01 -55.71 3 7 1 88 420.436 4 ↓
Lo Low (pH 4.5-6) -2.35 8.79 -81.38 3 7 1 94 420.436 3 ↓

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

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