In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 19 | Yes |
Popular Name: 1-[4-[[3-(1-amino-1-methyl-ethyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-yl]ethanone 1-[4-[[3-(1-amino-1-methyl-ethyl…
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) | -0.72 | -1.02 | -50.18 | 3 | 7 | 1 | 90 | 268.341 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.72 | -1.26 | -11.48 | 2 | 7 | 0 | 88 | 267.333 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.72 | 1.29 | -110.54 | 4 | 7 | 2 | 91 | 269.349 | 3 | ↓ |