| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2010 | 15 | Yes |
Popular Name: 2-[(3S)-3-methylpyrrolidin-1-yl]-N-(2-thienylmethyl)ethanamine 2-[(3S)-3-methylpyrrolidin-1-yl]…
| 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) | 2.30 | 6.1 | -33.83 | 2 | 2 | 1 | 16 | 225.381 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.30 | 3.64 | -2.04 | 1 | 2 | 0 | 15 | 224.373 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.30 | 7.46 | -115.54 | 3 | 2 | 2 | 21 | 226.389 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
