| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 15 | Yes |
Popular Name: N-[(3-methyl-2-thienyl)methyl]-2-pyrrolidin-1-yl-ethanamine N-[(3-methyl-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) | 2.21 | 5.95 | -35.17 | 2 | 2 | 1 | 16 | 225.381 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.21 | 3.42 | -3.03 | 1 | 2 | 0 | 15 | 224.373 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.21 | 7.37 | -116.99 | 3 | 2 | 2 | 21 | 226.389 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
