| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 10th, 2011 | 17 | Yes |
Popular Name: (3S)-3-(aminomethyl)-N-(cyclobutylmethyl)-N-methyl-quinuclidin-3-amine (3S)-3-(aminomethyl)-N-(cyclobut…
| 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) | 0.91 | 2.19 | -45.03 | 3 | 3 | 1 | 34 | 238.399 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.91 | 4.05 | -113.22 | 4 | 3 | 2 | 35 | 239.407 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.91 | 4.61 | -110.47 | 4 | 3 | 2 | 35 | 239.407 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.91 | 4.53 | -33.4 | 3 | 3 | 1 | 34 | 238.399 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.91 | 6.47 | -218.62 | 5 | 3 | 3 | 37 | 240.415 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
