In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2010 | 15 | Yes |
Popular Name: [6-[(1S,4R)-5-azabicyclo[2.2.1]heptan-5-yl]-2-pyridyl]methanamine [6-[(1S,4R)-5-azabicyclo[2.2.1]h…
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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) | 1.29 | 4.77 | -41.04 | 3 | 3 | 1 | 44 | 204.297 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.29 | 4.36 | -6.84 | 2 | 3 | 0 | 42 | 203.289 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.29 | 4.71 | -22.7 | 3 | 3 | 1 | 43 | 204.297 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.29 | 5.1 | -102.58 | 4 | 3 | 2 | 45 | 205.305 | 2 | ↓ |