In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2009 | 15 | Yes |
Popular Name: (2S)-2-[(3-propyl-1,2,4-oxadiazol-5-yl)methylamino]propanoic (2S)-2-[(3-propyl-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) | -1.23 | 2.72 | -39.22 | 2 | 6 | 0 | 96 | 213.237 | 6 | ↓ |
Hi High (pH 8-9.5) | -1.23 | 1.57 | -47.25 | 1 | 6 | -1 | 91 | 212.229 | 6 | ↓ |