In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2010 | 16 | Yes |
Popular Name: 1-[2-[(1S,4R)-5-azabicyclo[2.2.1]heptan-5-yl]-3-pyridyl]-N-methyl-methanamine 1-[2-[(1S,4R)-5-azabicyclo[2.2.1…
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) | 1.54 | 7 | -43.34 | 2 | 3 | 1 | 33 | 218.324 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.54 | 5.59 | -4.94 | 1 | 3 | 0 | 28 | 217.316 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.54 | 7.47 | -94.14 | 3 | 3 | 2 | 34 | 219.332 | 3 | ↓ |