In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2010 | 17 | Yes |
Popular Name: 6-(aminomethyl)-N-methyl-N-(3-pyridylmethyl)pyridin-2-amine 6-(aminomethyl)-N-methyl-N-(3-py…
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) | 0.56 | 4.62 | -44.54 | 3 | 4 | 1 | 57 | 229.307 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.56 | 4.19 | -29.33 | 3 | 4 | 1 | 56 | 229.307 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.56 | 4.22 | -7.73 | 2 | 4 | 0 | 55 | 228.299 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.56 | 4.58 | -107.98 | 4 | 4 | 2 | 58 | 230.315 | 4 | ↓ |