In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2011 | 19 | Yes |
Popular Name: [2-(9-chloro-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1H-imidazol-4-yl]methanol [2-(9-chloro-3,4-dihydro-2H-1,5-…
None
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) | 2.20 | 3.22 | -34.18 | 3 | 5 | 1 | 69 | 281.719 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.20 | 2.79 | -11.25 | 2 | 5 | 0 | 67 | 280.711 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.