| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 21 | Yes |
Popular Name: [4-(aminomethyl)phenyl]-[(3R)-3-pyrrolidin-1-yl-1-piperidyl]methanone [4-(aminomethyl)phenyl]-[(3R)-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 |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 0.91 | 6.6 | -111.2 | 4 | 4 | 2 | 52 | 289.423 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.91 | 6.2 | -41.82 | 3 | 4 | 1 | 51 | 288.415 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
