In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 15 | Yes |
Popular Name: [3,5-dimethyl-1-(1,2,4-oxadiazol-3-ylmethyl)pyrazol-4-yl]methanamine [3,5-dimethyl-1-(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) | -0.60 | -0.25 | -52.91 | 3 | 6 | 1 | 84 | 208.245 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.60 | -0.65 | -12.28 | 2 | 6 | 0 | 83 | 207.237 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.