| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 15th, 2011 | 18 | Yes |
Popular Name: (1S)-1-[3-chloro-4-(3-pyridyloxy)phenyl]-N-methyl-ethanamine (1S)-1-[3-chloro-4-(3-pyridyloxy…
| 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) | 3.34 | 6.72 | -45.17 | 2 | 3 | 1 | 39 | 263.748 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.34 | 5.55 | -4.84 | 1 | 3 | 0 | 34 | 262.74 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
