In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2011 | 16 | Yes |
Popular Name: (2R)-N-[[(2R)-1,4-dioxan-2-yl]methyl]piperazine-2-carboxamide (2R)-N-[[(2R)-1,4-dioxan-2-yl]me…
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) | -1.88 | -2.82 | -47.93 | 4 | 6 | 1 | 76 | 230.288 | 3 | ↓ |
Mid Mid (pH 6-8) | -1.88 | -4.17 | -8.23 | 3 | 6 | 0 | 72 | 229.28 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.