In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 21 | Yes |
Popular Name: (1S)-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(3-pyridyl)ethanamine (1S)-N-[2-(3,4-dimethoxyphenyl)e…
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) | 2.27 | 7.19 | -53.01 | 2 | 4 | 1 | 48 | 287.383 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.27 | 5.93 | -8.39 | 1 | 4 | 0 | 43 | 286.375 | 7 | ↓ |