| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2010 | 20 | Yes |
Popular Name: (1S,2R)-1-(4-propylphenoxy)-1-(3-thienyl)butan-2-amine (1S,2R)-1-(4-propylphenoxy)-1-(3…
| 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) | 4.21 | 8.44 | -42.57 | 3 | 2 | 1 | 37 | 290.452 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.21 | 8.14 | -3.43 | 2 | 2 | 0 | 35 | 289.444 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
