| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 18 | Yes |
Popular Name: (1S)-N-methyl-1-phenyl-N-(2-pyridylmethyl)ethane-1,2-diamine (1S)-N-methyl-1-phenyl-N-(2-pyri…
| 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) | 0.96 | 4.1 | -44.71 | 3 | 3 | 1 | 44 | 242.346 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.96 | 6.08 | -118.87 | 4 | 3 | 2 | 45 | 243.354 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.96 | 4.81 | -96.46 | 4 | 3 | 2 | 45 | 243.354 | 5 | ↓ |
