| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2008 | 17 | Yes |
Popular Name: (2S,3R)-2-amino-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-3-methyl-pentanamide (2S,3R)-2-amino-N-[[(2S)-1-ethyl…
| 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) | 0.70 | 3.34 | -94.78 | 5 | 4 | 2 | 61 | 243.395 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.70 | 3.06 | -39.18 | 4 | 4 | 1 | 60 | 242.387 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.70 | 0.97 | -46.1 | 4 | 4 | 1 | 60 | 242.387 | 6 | ↓ |
