| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 18 | Yes |
Popular Name: [(3R)-1-isopropyl-3-(4-methoxy-1-piperidyl)pyrrolidin-3-yl]methanamine [(3R)-1-isopropyl-3-(4-methoxy-1…
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|
| Hi High (pH 8-9.5) | -0.32 | 0.56 | -44.52 | 3 | 4 | 1 | 43 | 256.414 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.32 | 2.21 | -35.14 | 3 | 4 | 1 | 43 | 256.414 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.32 | 4.36 | -101.01 | 4 | 4 | 2 | 44 | 257.422 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.32 | -0.12 | -2 | 2 | 4 | 0 | 42 | 255.406 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.32 | 1.94 | -28.54 | 3 | 4 | 1 | 43 | 256.414 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.32 | 2.41 | -122.72 | 4 | 4 | 2 | 45 | 257.422 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -0.32 | 2.98 | -109.34 | 4 | 4 | 2 | 45 | 257.422 | 4 | ↓ |
