| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 15th, 2011 | 19 | Yes |
Popular Name: 3-[(2R)-1-[4-[(1S)-1-aminoethyl]-2-bromo-phenyl]pyrrolidin-2-yl]propan-1-ol 3-[(2R)-1-[4-[(1S)-1-aminoethyl]…
| 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) | 0.94 | 4.9 | -47.91 | 4 | 3 | 1 | 51 | 328.274 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.94 | 4.58 | -4.37 | 3 | 3 | 0 | 49 | 327.266 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
