| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 25th, 2011 | 17 | Yes |
Popular Name: (1S,2R)-2-(1-methylimidazol-2-yl)-N-propyl-cycloheptanamine (1S,2R)-2-(1-methylimidazol-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) | 2.64 | 8.22 | -97.53 | 3 | 3 | 2 | 36 | 237.391 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.64 | 8.12 | -30.16 | 2 | 3 | 1 | 34 | 236.383 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
