| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 21 | No |
Popular Name: (4R)-N-[(1S)-1-(2,4-dichlorophenyl)ethyl]isothiochroman-4-amine (4R)-N-[(1S)-1-(2,4-dichlorophen…
| 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) | 5.23 | 11.25 | -42.46 | 2 | 1 | 1 | 17 | 339.311 | 3 | ↓ |
| Mid Mid (pH 6-8) | 5.23 | 10.64 | -2.96 | 1 | 1 | 0 | 12 | 338.303 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
