In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 12th, 2011 | 22 | Yes |
Popular Name: 3-[5-[[methyl-(2,2,6,6-tetramethyl-4-piperidyl)amino]methyl]-3-thienyl]prop-2-yn-1-ol 3-[5-[[methyl-(2,2,6,6-tetrameth…
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) | 2.93 | 5.04 | -38.93 | 3 | 3 | 1 | 40 | 321.51 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.93 | 7.35 | -103.57 | 4 | 3 | 2 | 41 | 322.518 | 3 | ↓ |