| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 19 | Yes |
Popular Name: (2R)-2-amino-N-[(3-cyanophenyl)methyl]-N-methyl-butanediamide (2R)-2-amino-N-[(3-cyanophenyl)m…
| 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) | -0.12 | 0.93 | -44.24 | 5 | 6 | 1 | 115 | 261.305 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.12 | 0.6 | -17.93 | 4 | 6 | 0 | 113 | 260.297 | 5 | ↓ |
