| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 25th, 2009 | 17 | Yes |
Popular Name: (2R)-2-amino-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-4-methyl-pentanamide (2R)-2-amino-N-[[(2S)-1-ethylpyr…
| 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) | 0.73 | 3.38 | -92.52 | 5 | 4 | 2 | 61 | 243.395 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.92 | 0.99 | -47.3 | 4 | 4 | 1 | 67 | 242.387 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.92 | 0.7 | -37.43 | 3 | 4 | 0 | 66 | 241.379 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.73 | 3.09 | -36.76 | 4 | 4 | 1 | 60 | 242.387 | 6 | ↓ |
