| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 15th, 2011 | 17 | Yes |
Popular Name: (1R)-1-[3-chloro-4-(2-pyridylsulfanyl)phenyl]ethanamine (1R)-1-[3-chloro-4-(2-pyridylsul…
| 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) | 1.64 | 6.21 | -51.21 | 3 | 2 | 1 | 41 | 265.789 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.64 | 5.88 | -5.92 | 2 | 2 | 0 | 39 | 264.781 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
