| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 12th, 2011 | 17 | Yes |
Popular Name: N-[(S)-(1-propylimidazol-2-yl)-(1H-pyrazol-4-yl)methyl]ethanamine N-[(S)-(1-propylimidazol-2-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) | 1.00 | 4.18 | -30.89 | 3 | 5 | 1 | 60 | 234.327 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.00 | 4.87 | -39.62 | 3 | 5 | 1 | 63 | 234.327 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.00 | 3.7 | -9.85 | 2 | 5 | 0 | 59 | 233.319 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
