UCSF

ZINC49577202

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2010 19 Yes

Popular Name: (1R,5S)-N-[(3,4-difluorophenyl)methyl]-8-methyl-8-azabicyclo[3.2.1]octan-3-amine (1R,5S)-N-[(3,4-difluorophenyl)m…

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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) 2.55 8.17 -118.46 3 2 2 21 268.351 3 ↓
Hi High (pH 8-9.5) 2.55 7 -37.85 2 2 1 16 267.343 3 ↓
Mid Mid (pH 6-8) 2.55 5.82 -50.98 2 2 1 20 267.343 3 ↓

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

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