| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2010 | 21 | Yes |
Popular Name: (2S)-2-cyano-N-[(1R)-1-(dimethylaminomethyl)-2-methyl-propyl]-3-phenyl-propanamide (2S)-2-cyano-N-[(1R)-1-(dimethyl…
| 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) | 2.52 | 8.8 | -48.04 | 2 | 4 | 1 | 57 | 288.415 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.70 | 7.25 | -24.59 | 1 | 4 | 0 | 64 | 287.407 | 7 | ↓ |
