In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2011 | 19 | Yes |
Popular Name: [2-(9-bromo-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1H-imidazol-4-yl]methanol [2-(9-bromo-3,4-dihydro-2H-1,5-b…
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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) | 2.33 | 3.33 | -33.94 | 3 | 5 | 1 | 69 | 326.17 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.33 | 2.9 | -11.07 | 2 | 5 | 0 | 67 | 325.162 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.