| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 21 | Yes |
Popular Name: (3S)-3-amino-4-[(2S)-2-(3,4-dichlorophenyl)pyrrolidin-1-yl]-4-oxo-butanamide (3S)-3-amino-4-[(2S)-2-(3,4-dich…
| 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) | 2.02 | 2.89 | -41.18 | 5 | 5 | 1 | 91 | 331.223 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.02 | 2.55 | -12 | 4 | 5 | 0 | 89 | 330.215 | 4 | ↓ |
