In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 22nd, 2009 | 30 | Yes |
Popular Name: 3-phenyl-1-[4-[(1S)-1-[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]ethyl]piperazin-1-yl]propan-1-one 3-phenyl-1-[4-[(1S)-1-[3-(p-toly…
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) | 4.39 | 9.2 | -13.47 | 0 | 6 | 0 | 62 | 404.514 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.39 | 11.4 | -52.37 | 1 | 6 | 1 | 64 | 405.522 | 6 | ↓ |