| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2010 | 20 | Yes |
Popular Name: (3S)-3-(aminomethyl)-N-cyclopropyl-N-(3-thienylmethyl)quinuclidin-3-amine (3S)-3-(aminomethyl)-N-cycloprop…
| 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) | 1.22 | 5.57 | -112.46 | 4 | 3 | 2 | 35 | 293.48 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.22 | 5.61 | -34.89 | 3 | 3 | 1 | 34 | 292.472 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.22 | 3.15 | -44.75 | 3 | 3 | 1 | 34 | 292.472 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
