| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 19 | Yes |
Popular Name: (2R)-1-[(1S,2R)-2-amino-1-(5-chloro-2-thienyl)butyl]pyrrolidine-2-carboxamide (2R)-1-[(1S,2R)-2-amino-1-(5-chl…
| 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) | 2.05 | 2.87 | -36.68 | 5 | 4 | 1 | 74 | 302.851 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.05 | 1.12 | -7 | 4 | 4 | 0 | 72 | 301.843 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.05 | 1.33 | -57.86 | 5 | 4 | 1 | 74 | 302.851 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.80 | 1.61 | -30.36 | 4 | 4 | 0 | 77 | 301.843 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.05 | 3.19 | -123.08 | 6 | 4 | 2 | 75 | 303.859 | 5 | ↓ |
