| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 19 | Yes |
Popular Name: (1S)-1-[5-(1-adamantyl)-1H-imidazol-2-yl]propan-1-amine (1S)-1-[5-(1-adamantyl)-1H-imida…
| 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) | 1.54 | 6.24 | -29.52 | 4 | 3 | 1 | 56 | 260.405 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.54 | 6.53 | -115.83 | 5 | 3 | 2 | 58 | 261.413 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.55 | 6.16 | -48.66 | 4 | 3 | 1 | 56 | 260.405 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
