In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2011 | 19 | Yes |
Popular Name: (2R)-2-(1,3-dioxolan-2-yl)-1-[(3-fluorophenyl)methyl]piperidine (2R)-2-(1,3-dioxolan-2-yl)-1-[(3…
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) | 2.58 | 7.88 | -32.56 | 1 | 3 | 1 | 23 | 266.336 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.58 | 5.76 | -4.16 | 0 | 3 | 0 | 22 | 265.328 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.