UCSF

ZINC36331496

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 26th, 2009 18 No

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

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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) 0.68 2.45 -45.15 2 4 1 51 273.422 2 ↓
Lo Low (pH 4.5-6) 0.68 3.43 -126.77 3 4 2 55 274.43 2 ↓

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Rings

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

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