| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 25th, 2011 | 22 | Yes |
Popular Name: (2R)-2-[[(2R)-2-[(3,5-dimethylpyrazol-1-yl)methyl]morpholin-4-yl]methyl]pentanedinitrile (2R)-2-[[(2R)-2-[(3,5-dimethylpy…
| 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) | 0.58 | 5.94 | -20.34 | 0 | 6 | 0 | 78 | 301.394 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.58 | 7.97 | -66.49 | 1 | 6 | 1 | 79 | 302.402 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
