In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 21 | Yes |
Popular Name: (4R)-2,6,6-trimethyl-N-[(1R)-1-(3-pyridyl)ethyl]-5,7-dihydro-4H-benzofuran-4-amine (4R)-2,6,6-trimethyl-N-[(1R)-1-(…
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) | 2.38 | 8.5 | -40.86 | 2 | 3 | 1 | 43 | 285.411 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.38 | 8.98 | -104.92 | 3 | 3 | 2 | 44 | 286.419 | 3 | ↓ |