| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 20 | Yes |
Popular Name: (2S)-2-amino-N-methyl-N-[2-(2-methylphenoxy)ethyl]butanediamide (2S)-2-amino-N-methyl-N-[2-(2-me…
| 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) | 0.83 | 1.35 | -39.2 | 5 | 6 | 1 | 100 | 280.348 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.83 | 0.99 | -13.58 | 4 | 6 | 0 | 99 | 279.34 | 7 | ↓ |
