| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 21 | Yes |
Popular Name: (1S,2S)-N-[(1R)-1-(4-bromophenyl)propyl]-2-imidazol-1-yl-cyclopentanamine (1S,2S)-N-[(1R)-1-(4-bromophenyl…
| 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) | 3.03 | 11.18 | -51.4 | 2 | 3 | 1 | 34 | 349.296 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.03 | 10.36 | -6.94 | 1 | 3 | 0 | 30 | 348.288 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.03 | 11.91 | -105.18 | 3 | 3 | 2 | 36 | 350.304 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
