| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2008 | 22 | Yes |
Popular Name: (2R)-2-amino-N-[2-(3H-imidazol-4-yl)ethyl]-3-(1H-indol-3-yl)propanamide (2R)-2-amino-N-[2-(3H-imidazol-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) | 0.27 | 4.22 | -95.1 | 7 | 6 | 2 | 102 | 299.378 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.27 | 3.47 | -15.02 | 5 | 6 | 0 | 100 | 297.362 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.27 | 3.77 | -51.15 | 6 | 6 | 1 | 101 | 298.37 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.