In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2009 | 12 | Yes |
Popular Name: (2S)-1-[(3-methyl-1,2,4-oxadiazol-5-yl)methylamino]propan-2-ol (2S)-1-[(3-methyl-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) | -0.69 | -1.78 | -46.58 | 3 | 5 | 1 | 76 | 172.208 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.69 | -3.2 | -8.48 | 2 | 5 | 0 | 71 | 171.2 | 4 | ↓ |