| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 17 | Yes |
Popular Name: (3R)-3-(aminomethyl)-N-ethyl-N-[(1S)-1-methylpropyl]quinuclidin-3-amine (3R)-3-(aminomethyl)-N-ethyl-N-[…
| 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) | 1.45 | 4.09 | -105.31 | 4 | 3 | 2 | 35 | 241.423 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | 1.65 | -40.93 | 3 | 3 | 1 | 34 | 240.415 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | 4.08 | -33.02 | 3 | 3 | 1 | 34 | 240.415 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.45 | 2.68 | -29.14 | 3 | 3 | 1 | 34 | 240.415 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.45 | 2.78 | -114.1 | 4 | 3 | 2 | 35 | 241.423 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.45 | 5.21 | -93.61 | 4 | 3 | 2 | 35 | 241.423 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.45 | 5.45 | -204.8 | 5 | 3 | 3 | 37 | 242.431 | 5 | ↓ |
