| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 30th, 2010 | 19 | Yes |
Popular Name: (3R)-3-(aminomethyl)-N-butyl-N-[(1R)-1-methylpropyl]quinuclidin-3-amine (3R)-3-(aminomethyl)-N-butyl-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 |
|---|---|---|---|---|---|---|---|---|---|---|
| Hi High (pH 8-9.5) | 2.52 | 3.19 | -41.32 | 3 | 3 | 1 | 34 | 268.469 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.52 | 5.27 | -32.64 | 3 | 3 | 1 | 34 | 268.469 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.52 | 6.01 | -97.23 | 4 | 3 | 2 | 35 | 269.477 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.52 | 5.62 | -109.12 | 4 | 3 | 2 | 35 | 269.477 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.52 | 2.74 | -118.14 | 4 | 3 | 2 | 35 | 269.477 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.52 | 6.3 | -213 | 5 | 3 | 3 | 37 | 270.485 | 7 | ↓ |
