In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 20 | Yes |
Popular Name: 2-[2-(aminomethyl)phenoxy]-N-methyl-N-(3-pyridylmethyl)ethanamine 2-[2-(aminomethyl)phenoxy]-N-met…
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) | 1.32 | 6.07 | -107.26 | 4 | 4 | 2 | 54 | 273.38 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.32 | 3.32 | -7.46 | 2 | 4 | 0 | 51 | 271.364 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.32 | 3.74 | -40.94 | 3 | 4 | 1 | 53 | 272.372 | 7 | ↓ |