In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2008 | 20 | Yes |
Popular Name: (2S)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]pyrrolidine-2-carboxamide (2S)-1-[(3-phenyl-1,2,4-oxadiazo…
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) | 1.53 | 2.94 | -44.55 | 3 | 6 | 1 | 86 | 273.316 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.29 | 1.44 | -36.04 | 2 | 6 | 0 | 90 | 272.308 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.