| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 16 | Yes |
Popular Name: [3,5-dimethyl-1-(2-pyrrolidin-1-ylethyl)pyrazol-4-yl]methanamine [3,5-dimethyl-1-(2-pyrrolidin-1-…
| 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) | 0.38 | 4.59 | -95.5 | 4 | 4 | 2 | 50 | 224.352 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.38 | 4.19 | -37.29 | 3 | 4 | 1 | 48 | 223.344 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.38 | 2.14 | -47.25 | 3 | 4 | 1 | 49 | 223.344 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
