| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 15th, 2011 | 18 | Yes |
Popular Name: (1R)-1-(3-chloro-4-phenylsulfanyl-phenyl)-N-methyl-ethanamine (1R)-1-(3-chloro-4-phenylsulfany…
| 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) | 4.63 | 9.59 | -42.94 | 2 | 1 | 1 | 17 | 278.828 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.63 | 8.42 | -4.07 | 1 | 1 | 0 | 12 | 277.82 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
