| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2010 | 20 | Yes |
Popular Name: (1R)-1-[4-(aminomethyl)phenyl]-2-[methyl-[[(2S)-tetrahydropyran-2-yl]methyl]amino]ethanol (1R)-1-[4-(aminomethyl)phenyl]-2…
| 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) | 1.22 | 4.1 | -88.62 | 5 | 4 | 2 | 62 | 280.412 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.22 | 1.64 | -46.73 | 4 | 4 | 1 | 60 | 279.404 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
