| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 19 | Yes |
Popular Name: (2R)-1-[(1R,2S)-2-amino-1-(3-methyl-2-thienyl)propyl]-N-methyl-pyrrolidine-2-carboxamide (2R)-1-[(1R,2S)-2-amino-1-(3-met…
| 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) | 0.90 | 3.38 | -33.55 | 4 | 4 | 1 | 60 | 282.433 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.90 | 1.86 | -7.1 | 3 | 4 | 0 | 58 | 281.425 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.90 | 2.19 | -36.46 | 4 | 4 | 1 | 60 | 282.433 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.90 | 3.72 | -109.68 | 5 | 4 | 2 | 61 | 283.441 | 4 | ↓ |
