| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 22nd, 2011 | 17 | Yes |
Popular Name: 4-[[2-[cyclopropyl(methyl)amino]ethylamino]methyl]benzene-1,3-diol 4-[[2-[cyclopropyl(methyl)amino]…
| 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) | 1.33 | 0.02 | -41.79 | 4 | 4 | 1 | 60 | 237.323 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.33 | 0.78 | -36.03 | 3 | 4 | 0 | 63 | 236.315 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.33 | 0.93 | -35.98 | 4 | 4 | 1 | 57 | 237.323 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.33 | 2.32 | -115.36 | 5 | 4 | 2 | 61 | 238.331 | 6 | ↓ |
