In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2010 | 16 | Yes |
Popular Name: (1R)-N-methyl-1-[3-(4-pyridylmethyl)-1,2,4-oxadiazol-5-yl]ethanamine (1R)-N-methyl-1-[3-(4-pyridylmet…
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) | 0.83 | 2.18 | -44.96 | 2 | 5 | 1 | 68 | 219.268 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.83 | 0.92 | -8.41 | 1 | 5 | 0 | 64 | 218.26 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.83 | 2.65 | -88.67 | 3 | 5 | 2 | 70 | 220.276 | 4 | ↓ |