UCSF

ZINC65528224

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 19 Yes

Popular Name: (1R,6S)-9-[(4,5-dichloro-2-thienyl)sulfonyl]-4,9-diazabicyclo[4.2.1]nonane (1R,6S)-9-[(4,5-dichloro-2-thien…

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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 4.12 -43.4 2 4 1 54 342.293 2 ↓
Hi High (pH 8-9.5) 2.55 2.79 -6.65 1 4 0 49 341.285 2 ↓

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

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