UCSF

ZINC38019169

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 21st, 2009 19 Yes

Popular Name: (1S)-1-(5-chloro-2-thienyl)-N-[[(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl]methyl]ethanamine (1S)-1-(5-chloro-2-thienyl)-N-[[…

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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) 3.94 8.76 -98.41 3 2 2 21 300.899 4 ↓
Hi High (pH 8-9.5) 3.94 7.9 -33.01 2 2 1 16 299.891 4 ↓

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Rings

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

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