In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 20 | Yes |
Popular Name: 1-methyl-N-[(4S)-2,6,6-trimethyl-5,7-dihydro-4H-benzofuran-4-yl]piperidin-4-amine 1-methyl-N-[(4S)-2,6,6-trimethyl…
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) | 2.07 | 7.73 | -35.95 | 2 | 3 | 1 | 30 | 277.432 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.07 | 8.3 | -102.03 | 3 | 3 | 2 | 34 | 278.44 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.07 | 5.91 | -38.66 | 2 | 3 | 1 | 33 | 277.432 | 2 | ↓ |