UCSF

ZINC53342486

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2010 16 Yes

Popular Name: N-[2-[(1S,4R)-5-azabicyclo[2.2.1]heptan-5-yl]ethyl]cyclohexanamine N-[2-[(1S,4R)-5-azabicyclo[2.2.1…

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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) 2.92 7.91 -112.33 3 2 2 21 224.392 4 ↓
Hi High (pH 8-9.5) 2.92 6.75 -30.7 2 2 1 16 223.384 4 ↓
Mid Mid (pH 6-8) 2.92 5.7 -36.37 2 2 1 20 223.384 4 ↓

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

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