| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 7th, 2010 | 17 | Yes |
Popular Name: 3-[cyclopropyl-[(1-ethylimidazol-2-yl)methyl]amino]propanoic 3-[cyclopropyl-[(1-ethylimidazol…
| 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) | 0.16 | 8.67 | -89.45 | 2 | 5 | 1 | 64 | 238.311 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.16 | 5.85 | -49.8 | 0 | 5 | -1 | 61 | 236.295 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.16 | 7.1 | -54.11 | 1 | 5 | 0 | 62 | 237.303 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.16 | 8.43 | -51.82 | 1 | 5 | 0 | 62 | 237.303 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
