| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 24th, 2011 | 19 | Yes |
Popular Name: 3,3,3-trifluoro-N-[[3-(5-methyl-2-furyl)-1H-pyrazol-4-yl]methyl]propan-1-amine 3,3,3-trifluoro-N-[[3-(5-methyl-…
| 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) | 2.04 | 5.51 | -47.12 | 3 | 4 | 1 | 58 | 274.266 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.04 | 4.11 | -5.99 | 2 | 4 | 0 | 54 | 273.258 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
