| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2010 | 17 | Yes |
Popular Name: N-[[(2S)-1-[(4-bromo-2-thienyl)methyl]pyrrolidin-2-yl]methyl]propan-1-amine N-[[(2S)-1-[(4-bromo-2-thienyl)m…
| 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) | 3.08 | 7.17 | -38.57 | 2 | 2 | 1 | 20 | 318.304 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.08 | 8.99 | -118.25 | 3 | 2 | 2 | 21 | 319.312 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
