In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2010 | 28 | Yes |
Popular Name: 1-(4-but-3-ynylpiperazin-1-yl)-3-[3-(4-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]propan-1-one 1-(4-but-3-ynylpiperazin-1-yl)-3…
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) | 2.60 | 6.51 | -11.44 | 0 | 7 | 0 | 72 | 382.464 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.60 | 8.74 | -51.38 | 1 | 7 | 1 | 73 | 383.472 | 8 | ↓ |