| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 21 | Yes |
Popular Name: (2S)-2-amino-N-[(4-cyanophenyl)methyl]-4-methyl-N-propyl-pentanamide (2S)-2-amino-N-[(4-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) | 2.21 | 7.7 | -47.25 | 3 | 4 | 1 | 72 | 288.415 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.21 | 7.37 | -9.66 | 2 | 4 | 0 | 70 | 287.407 | 7 | ↓ |
