| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2009 | 18 | Yes |
Popular Name: 4-[[[(1S)-1-methylheptyl]amino]methyl]benzene-1,3-diol 4-[[[(1S)-1-methylheptyl]amino]m…
| 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) | 4.22 | 4.05 | -39.23 | 4 | 3 | 1 | 57 | 252.378 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.22 | 4.81 | -34.06 | 3 | 3 | 0 | 60 | 251.37 | 8 | ↓ |
