| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 11th, 2011 | 18 | Yes |
Popular Name: 2-[(3,5-dichloro-4-hydroxy-phenyl)methylamino]-2-methyl-propane-1,1,1-triol 2-[(3,5-dichloro-4-hydroxy-pheny…
| 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) | 1.43 | -2.36 | -45.46 | 6 | 5 | 1 | 98 | 297.158 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.43 | -0.88 | -61.17 | 4 | 5 | -1 | 103 | 295.142 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.43 | -1.64 | -36.1 | 5 | 5 | 0 | 100 | 296.15 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.43 | -1.6 | -55.29 | 5 | 5 | 0 | 100 | 296.15 | 4 | ↓ |
