In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 27th, 2010 | 15 | Yes |
Popular Name: (2S)-2-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methylamino]propanoic (2S)-2-[(3-cyclopropyl-1,2,4-oxa…
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) | -1.94 | 2.87 | -39.68 | 2 | 6 | 0 | 96 | 211.221 | 5 | ↓ |
Hi High (pH 8-9.5) | -1.94 | 1.61 | -45.75 | 1 | 6 | -1 | 91 | 210.213 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.