In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2011 | 16 | Yes |
Popular Name: N-[[2-[[(2R)-tetrahydrofuran-2-yl]methyl]-1H-imidazol-4-yl]methyl]propan-1-amine N-[[2-[[(2R)-tetrahydrofuran-2-y…
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) | 1.26 | 4.37 | -36.57 | 3 | 4 | 1 | 55 | 224.328 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.26 | 3 | -7.22 | 2 | 4 | 0 | 50 | 223.32 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.26 | 4.79 | -100.66 | 4 | 4 | 2 | 56 | 225.336 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.