In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 18 | Yes |
Popular Name: (1S)-3-methoxy-1-[3-(4-pyridylmethyl)-1,2,4-oxadiazol-5-yl]propan-1-amine (1S)-3-methoxy-1-[3-(4-pyridylme…
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) | -1.55 | 0.35 | -54.08 | 3 | 6 | 1 | 89 | 249.294 | 6 | ↓ |
Hi High (pH 8-9.5) | -1.55 | 0.06 | -8.64 | 2 | 6 | 0 | 87 | 248.286 | 6 | ↓ |
Lo Low (pH 4.5-6) | -1.55 | 0.81 | -94.73 | 4 | 6 | 2 | 90 | 250.302 | 6 | ↓ |