| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 30th, 2010 | 18 | Yes |
Popular Name: (3R)-3-(aminomethyl)-N-[(1R)-1,3-dimethylbutyl]-N-methyl-quinuclidin-3-amine (3R)-3-(aminomethyl)-N-[(1R)-1,3…
| 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) | 1.85 | 3.51 | -34.91 | 3 | 3 | 1 | 34 | 254.442 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.85 | 1.86 | -40.88 | 3 | 3 | 1 | 34 | 254.442 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.85 | 5.41 | -96.93 | 4 | 3 | 2 | 35 | 255.45 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.85 | 4.3 | -109.16 | 4 | 3 | 2 | 35 | 255.45 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.85 | 1.9 | -125.59 | 4 | 3 | 2 | 35 | 255.45 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.85 | 5.73 | -221.33 | 5 | 3 | 3 | 37 | 256.458 | 5 | ↓ |
