| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 18 | Yes |
Popular Name: 2-chloro-4-[[[(1R)-2-(diethylamino)-1-methyl-ethyl]amino]methyl]phenol 2-chloro-4-[[[(1R)-2-(diethylami…
| 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) | 3.00 | 4.35 | -40.73 | 3 | 3 | 1 | 40 | 271.812 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.00 | 6.91 | -120.45 | 3 | 3 | 1 | 44 | 271.812 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.00 | 5.47 | -55.01 | 2 | 3 | 0 | 43 | 270.804 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.00 | 6.39 | -34.65 | 3 | 3 | 1 | 37 | 271.812 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.00 | 6.4 | -119.73 | 4 | 3 | 2 | 41 | 272.82 | 7 | ↓ |
