| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 20 | Yes |
Popular Name: 1-[1-(1-ethylpropyl)pyrazol-3-yl]-N-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]methanamine 1-[1-(1-ethylpropyl)pyrazol-3-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) | 2.72 | 7.66 | -31.32 | 2 | 4 | 1 | 34 | 279.452 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.72 | 7.21 | -33.77 | 2 | 4 | 1 | 38 | 279.452 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.72 | 9.27 | -108.08 | 3 | 4 | 2 | 39 | 280.46 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
