| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 17 | Yes |
Popular Name: (3S)-3-(aminomethyl)-N-isopentyl-N-methyl-quinuclidin-3-amine (3S)-3-(aminomethyl)-N-isopentyl…
| 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) | 1.52 | 4.74 | -109.99 | 4 | 3 | 2 | 35 | 241.423 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.52 | 4.51 | -33.29 | 3 | 3 | 1 | 34 | 240.415 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.52 | 2.32 | -44.64 | 3 | 3 | 1 | 34 | 240.415 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.52 | 4.12 | -112.73 | 4 | 3 | 2 | 35 | 241.423 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.52 | 6.5 | -98.46 | 4 | 3 | 2 | 35 | 241.423 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.52 | 6.56 | -217.33 | 5 | 3 | 3 | 37 | 242.431 | 5 | ↓ |
