In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 19 | Yes |
Popular Name: 3-[[(1S,2S)-2-amino-1-(p-tolyl)propyl]-cyclopropyl-amino]propanenitrile 3-[[(1S,2S)-2-amino-1-(p-tolyl)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) | 1.40 | 6.46 | -47.48 | 3 | 3 | 1 | 55 | 258.389 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.40 | 7.53 | -138.38 | 4 | 3 | 2 | 56 | 259.397 | 6 | ↓ |