In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 28th, 2005 | 21 | Yes |
Popular Name: 3,3-dimethyl-2-(3,4,5-trimethoxyphenyl)-4-piperidinone 3,3-dimethyl-2-(3,4,5-trimethoxy…
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) | 1.77 | 5.33 | -57.07 | 2 | 5 | 1 | 61 | 294.371 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.77 | 4.33 | -10.02 | 1 | 5 | 0 | 57 | 293.363 | 4 | ↓ |