| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2011 | 20 | Yes |
Popular Name: (2S)-2-(2-ethylbenzimidazol-1-yl)-2-(1-methylpyrazol-4-yl)ethanamine (2S)-2-(2-ethylbenzimidazol-1-yl…
| 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) | 0.92 | 5.47 | -59.05 | 3 | 5 | 1 | 63 | 270.36 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.92 | 5.26 | -13.9 | 2 | 5 | 0 | 62 | 269.352 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.92 | 5.75 | -104.28 | 4 | 5 | 2 | 65 | 271.368 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
