| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 21st, 2010 | 16 | Yes |
Popular Name: (2S)-2-amino-N-[(3R)-1-cyclopropylpyrrolidin-3-yl]-3-methyl-butanamide (2S)-2-amino-N-[(3R)-1-cycloprop…
| 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) | -0.08 | 3.33 | -91.9 | 5 | 4 | 2 | 61 | 227.352 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.08 | 3.03 | -37.89 | 4 | 4 | 1 | 60 | 226.344 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.10 | 1.08 | -38.95 | 3 | 4 | 0 | 66 | 225.336 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.10 | 1.52 | -58.08 | 4 | 4 | 1 | 67 | 226.344 | 4 | ↓ |
