| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2008 | 19 | Yes |
Popular Name: (1S)-N-methyl-1-phenyl-N-[2-(4-pyridyl)ethyl]ethane-1,2-diamine (1S)-N-methyl-1-phenyl-N-[2-(4-p…
| 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) | -0.03 | 7.39 | -44.67 | 3 | 3 | 1 | 43 | 256.373 | 6 | ↓ |
| Hi High (pH 8-9.5) | -0.03 | 5.41 | -4.74 | 2 | 3 | 0 | 42 | 255.365 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.03 | 5.7 | -49.01 | 3 | 3 | 1 | 44 | 256.373 | 6 | ↓ |
