| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 16 | Yes |
Popular Name: (1S)-N-(2-pyrrolidin-1-ylethyl)-1-(2-thienyl)propan-1-amine (1S)-N-(2-pyrrolidin-1-ylethyl)-…
| 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) | 2.89 | 6.66 | -34.42 | 2 | 2 | 1 | 16 | 239.408 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.89 | 4.14 | -1.94 | 1 | 2 | 0 | 15 | 238.4 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.89 | 5.42 | -37.23 | 2 | 2 | 1 | 20 | 239.408 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.89 | 7.95 | -115.67 | 3 | 2 | 2 | 21 | 240.416 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
