| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 21 | Yes |
Popular Name: 4-[[[(1S)-1-(4-isopropylphenyl)ethyl]amino]methyl]benzene-1,3-diol 4-[[[(1S)-1-(4-isopropylphenyl)e…
| 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) | 4.40 | 5.17 | -41.53 | 4 | 3 | 1 | 57 | 286.395 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.40 | 4.01 | -5.63 | 3 | 3 | 0 | 52 | 285.387 | 5 | ↓ |
