| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 9th, 2011 | 21 | Yes |
Popular Name: (2S,4S)-4-amino-N,N-diethyl-1-(4-methyl-1H-imidazole-5-carbonyl)pyrrolidine-2-carboxamide (2S,4S)-4-amino-N,N-diethyl-1-(4…
| 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) | -1.09 | 3.9 | -63.93 | 4 | 7 | 1 | 97 | 294.379 | 4 | ↓ |
| Hi High (pH 8-9.5) | -1.09 | 3.6 | -18.89 | 3 | 7 | 0 | 95 | 293.371 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -1.09 | 4.09 | -120.94 | 5 | 7 | 2 | 98 | 295.387 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
