In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 13 | Yes |
Popular Name: 3-[[(1S,2S)-2-aminocyclopentyl]-ethyl-amino]propanenitrile 3-[[(1S,2S)-2-aminocyclopentyl]-…
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) | -0.07 | 1.81 | -48.04 | 3 | 3 | 1 | 55 | 182.291 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.07 | 4.06 | -123.85 | 4 | 3 | 2 | 56 | 183.299 | 4 | ↓ |