In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 20 | Yes |
Popular Name: N-[[1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-3,5-dimethyl-pyrazol-4-yl]methyl]propan-2-amine N-[[1-[(3-ethyl-1,2,4-oxadiazol-…
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) | 1.24 | 4.45 | -43.84 | 2 | 6 | 1 | 73 | 278.38 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.24 | 3.24 | -10.25 | 1 | 6 | 0 | 69 | 277.372 | 6 | ↓ |