In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2011 | 21 | No |
Popular Name: (2R)-2-[(3,5-dimethylpyrazol-1-yl)methyl]-4-(3-methylsulfonylpropyl)morpholine (2R)-2-[(3,5-dimethylpyrazol-1-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) | 0.36 | 1.84 | -18.62 | 0 | 6 | 0 | 64 | 315.439 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.36 | 4.11 | -56.9 | 1 | 6 | 1 | 66 | 316.447 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.