In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 12th, 2011 | 14 | Yes |
Popular Name: N-[[5-(1H-pyrazol-4-yl)-1,3,4-oxadiazol-2-yl]methyl]ethanamine N-[[5-(1H-pyrazol-4-yl)-1,3,4-ox…
None
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) | -0.40 | -2.31 | -44.83 | 3 | 6 | 1 | 84 | 194.218 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.40 | -3.67 | -9.01 | 2 | 6 | 0 | 80 | 193.21 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.