| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 25th, 2010 | 18 | Yes |
Popular Name: 2-amino-1-[(1S)-2-imidazol-1-yl-1-methyl-ethyl]-4,5-dimethyl-pyrrole-3-carbonitrile 2-amino-1-[(1S)-2-imidazol-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) | 0.85 | 8.11 | -12.22 | 2 | 5 | 0 | 73 | 243.314 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.85 | 8.62 | -46.35 | 3 | 5 | 1 | 74 | 244.322 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
