| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 16 | Yes |
Popular Name: [(3S)-1-isopropyl-3-[(2S)-2-methylpyrrolidin-1-yl]pyrrolidin-3-yl]methanamine [(3S)-1-isopropyl-3-[(2S)-2-meth…
| 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) | 0.77 | 2.58 | -27.42 | 3 | 3 | 1 | 34 | 226.388 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.77 | 1.28 | -39.67 | 3 | 3 | 1 | 34 | 226.388 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.77 | 2.93 | -31.44 | 3 | 3 | 1 | 34 | 226.388 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.77 | 5.05 | -90.47 | 4 | 3 | 2 | 35 | 227.396 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.77 | 2.99 | -114.45 | 4 | 3 | 2 | 35 | 227.396 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.77 | 3.76 | -105.38 | 4 | 3 | 2 | 35 | 227.396 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.77 | 5.46 | -215.94 | 5 | 3 | 3 | 37 | 228.404 | 3 | ↓ |
