| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2010 | 19 | No |
Popular Name: (4S)-N-[(1R)-1-(2-thienyl)propyl]isothiochroman-4-amine (4S)-N-[(1R)-1-(2-thienyl)propyl…
| 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) | 4.35 | 9.91 | -35.78 | 2 | 1 | 1 | 17 | 290.477 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.35 | 8.79 | -3.63 | 1 | 1 | 0 | 12 | 289.469 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
