| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 21 | Yes |
Popular Name: (1R)-1-(1,5-dimethylpyrazol-4-yl)-N-(quinoxalin-2-ylmethyl)ethanamine (1R)-1-(1,5-dimethylpyrazol-4-yl…
| 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) | 2.09 | 5.43 | -47.92 | 2 | 5 | 1 | 60 | 282.371 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.09 | 4.29 | -11.83 | 1 | 5 | 0 | 56 | 281.363 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
