In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 11th, 2008 | 28 | Yes |
Popular Name: N-[[1-(2,4-difluorophenyl)-3-(o-tolyl)pyrazol-4-yl]methyl]-3-ethoxy-propan-1-amine N-[[1-(2,4-difluorophenyl)-3-(o-…
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) | 4.32 | 11.63 | -51.7 | 2 | 4 | 1 | 44 | 386.466 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.32 | 11.01 | -11.62 | 1 | 4 | 0 | 39 | 385.458 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.