| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 18 | Yes |
Popular Name: (1S)-2-methyl-N-[(1R)-1-(3-pyridyl)ethyl]-1-(2-thienyl)propan-1-amine (1S)-2-methyl-N-[(1R)-1-(3-pyrid…
| 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) | 3.42 | 7.92 | -36.87 | 2 | 2 | 1 | 29 | 261.414 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.42 | 7.1 | -4.97 | 1 | 2 | 0 | 25 | 260.406 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
