| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 20 | Yes |
Popular Name: (2S)-2-amino-N-[(4-isopropylphenyl)methyl]-N-methyl-butanediamide (2S)-2-amino-N-[(4-isopropylphen…
| 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) | 1.66 | 2.46 | -37.98 | 5 | 5 | 1 | 91 | 278.376 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.66 | 2.11 | -11.4 | 4 | 5 | 0 | 89 | 277.368 | 6 | ↓ |
