In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2010 | 16 | Yes |
Popular Name: (3S)-1-[[1-(difluoromethyl)imidazol-2-yl]methyl]piperidin-3-ol (3S)-1-[[1-(difluoromethyl)imida…
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) | 0.22 | 3.25 | -36.75 | 2 | 4 | 1 | 42 | 232.254 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.22 | 1.12 | -6.55 | 1 | 4 | 0 | 41 | 231.246 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.