In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2011 | 13 | Yes |
Popular Name: [2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-imidazol-4-yl]methanamine [2-[[(2R)-tetrahydrofuran-2-yl]m…
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) | 0.01 | 0.88 | -41.63 | 4 | 4 | 1 | 66 | 182.247 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.01 | 0.47 | -8.39 | 3 | 4 | 0 | 64 | 181.239 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.01 | 1.3 | -101.08 | 5 | 4 | 2 | 67 | 183.255 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.