| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 25th, 2011 | 18 | Yes |
Popular Name: N-[(R)-(2-methylpyrazol-3-yl)-(6-methyl-2-pyridyl)methyl]propan-1-amine N-[(R)-(2-methylpyrazol-3-yl)-(6…
| 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) | 1.72 | 6.06 | -38.07 | 2 | 4 | 1 | 47 | 245.35 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.72 | 4.69 | -8.49 | 1 | 4 | 0 | 43 | 244.342 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
