| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2009 | 24 | Yes |
Popular Name: 2-[[(1S)-2-amino-1-[4-(2,3,6-trimethylphenoxy)phenyl]ethyl]-methyl-amino]ethanol 2-[[(1S)-2-amino-1-[4-(2,3,6-tri…
| 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) | 3.05 | 5.05 | -53.22 | 4 | 4 | 1 | 60 | 329.464 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.05 | 6.89 | -32.63 | 4 | 4 | 1 | 60 | 329.464 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.05 | 7.01 | -127.25 | 5 | 4 | 2 | 62 | 330.472 | 7 | ↓ |
