| 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-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) | -0.31 | 4.63 | -39.57 | 3 | 3 | 1 | 44 | 242.346 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.31 | 3.85 | -5.41 | 2 | 3 | 0 | 42 | 241.338 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.31 | 5.34 | -94.44 | 4 | 3 | 2 | 45 | 243.354 | 5 | ↓ |
