| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 19 | Yes |
Popular Name: 3-[[(1S,2S)-2-amino-1-(p-tolyl)butyl]-ethyl-amino]propanenitrile 3-[[(1S,2S)-2-amino-1-(p-tolyl)b…
| 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) | 1.95 | 6.27 | -51.82 | 3 | 3 | 1 | 55 | 260.405 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.95 | 7.92 | -128.28 | 4 | 3 | 2 | 56 | 261.413 | 7 | ↓ |
