| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 15th, 2011 | 22 | Yes |
Popular Name: (2S,4S)-4-amino-1-(1H-benzimidazole-5-carbonyl)-N-ethyl-pyrrolidine-2-carboxamide (2S,4S)-4-amino-1-(1H-benzimidaz…
| 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) | -1.16 | 1.61 | -67.44 | 5 | 7 | 1 | 106 | 302.358 | 3 | ↓ |
| Hi High (pH 8-9.5) | -1.16 | 1.34 | -19.8 | 4 | 7 | 0 | 104 | 301.35 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -1.16 | 2.1 | -122.53 | 6 | 7 | 2 | 107 | 303.366 | 3 | ↓ |
