UCSF

ZINC61367261

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 9th, 2011 20 Yes

Popular Name: (1R,5S)-N-methyl-9-[(4R)-4,5,6,7-tetrahydrobenzothiophen-4-yl]-9-azabicyclo[3.3.1]nonan-7-amine (1R,5S)-N-methyl-9-[(4R)-4,5,6,7…

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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) 3.39 7.63 -43.09 2 2 1 20 291.484 2 ↓
Mid Mid (pH 6-8) 3.39 8.67 -103.51 3 2 2 21 292.492 2 ↓

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Rings

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

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