UCSF

ZINC48942347

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 21st, 2010 20 Yes

Popular Name: 2-[(1R,4S)-5-azabicyclo[2.2.1]heptane-5-carbonyl]-1H-quinolin-4-one 2-[(1R,4S)-5-azabicyclo[2.2.1]he…

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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) 1.44 7.29 -17.96 1 4 0 53 268.316 1 ↓
Mid Mid (pH 6-8) 2.74 6.14 -53.6 0 4 -1 56 267.308 1 ↓

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

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