In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 27th, 2010 | 18 | Yes |
Popular Name: [3,5-dimethyl-1-[(5-propyl-1,2,4-oxadiazol-3-yl)methyl]pyrazol-4-yl]methanamine [3,5-dimethyl-1-[(5-propyl-1,2,4…
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) | 0.69 | 2.03 | -51.47 | 3 | 6 | 1 | 84 | 250.326 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.69 | 1.62 | -10.51 | 2 | 6 | 0 | 83 | 249.318 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.