In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 27th, 2006 | 19 | No |
Popular Name: 2-hydroxy-6-methyl-3-[3-(1-piperidyl)prop-2-enoyl]pyran-4-one 2-hydroxy-6-methyl-3-[3-(1-piper…
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 |
---|---|---|---|---|---|---|---|---|---|---|
Mid Mid (pH 6-8) | 1.41 | 7.8 | -55.4 | 0 | 5 | -1 | 74 | 262.285 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.41 | 6.81 | -18.86 | 1 | 5 | 0 | 71 | 263.293 | 3 | ↓ |