In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 13th, 2009 | 16 | Yes |
Popular Name: [6-[6-(aminomethyl)-2-pyridyl]-2-pyridyl]methanamine [6-[6-(aminomethyl)-2-pyridyl]-2…
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) | -0.05 | 0.79 | -96 | 6 | 4 | 2 | 81 | 216.288 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.05 | -0.01 | -6.58 | 4 | 4 | 0 | 78 | 214.272 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.05 | 0.39 | -47.83 | 5 | 4 | 1 | 79 | 215.28 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US5162508; US5346996; US5457185; US5534622 | IBM Patent Data |