| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 19 | No |
Popular Name: (4S)-N-[(1S)-1-(5-chloro-2-thienyl)ethyl]isothiochroman-4-amine (4S)-N-[(1S)-1-(5-chloro-2-thien…
| 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) | 4.65 | 9.24 | -39.59 | 2 | 1 | 1 | 17 | 310.895 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.65 | 8.81 | -3.26 | 1 | 1 | 0 | 12 | 309.887 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
