| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2010 | 16 | Yes |
Popular Name: N-[(4-bromo-2-thienyl)methyl]-2-[(2R)-2-methylpyrrolidin-1-yl]ethanamine N-[(4-bromo-2-thienyl)methyl]-2-…
| 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) | 2.90 | 6.73 | -33.17 | 2 | 2 | 1 | 16 | 304.277 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.90 | 4.48 | -1.98 | 1 | 2 | 0 | 15 | 303.269 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.90 | 8.08 | -117.53 | 3 | 2 | 2 | 21 | 305.285 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
