| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2010 | 21 | Yes |
Popular Name: (2S)-2-[2-(1,3-benzothiazol-2-yl)phenoxy]-N-methyl-propan-1-amine (2S)-2-[2-(1,3-benzothiazol-2-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) | 4.45 | 8.29 | -40.63 | 2 | 3 | 1 | 39 | 299.419 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.45 | 6.85 | -9.17 | 1 | 3 | 0 | 34 | 298.411 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
