In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 19 | Yes |
Popular Name: (1S)-1-(p-tolyl)-2-[(6S)-2,2,6-trimethylmorpholin-4-yl]ethanamine (1S)-1-(p-tolyl)-2-[(6S)-2,2,6-t…
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) | 0.92 | 5.55 | -44.89 | 3 | 3 | 1 | 40 | 263.405 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.92 | 5.14 | -3.09 | 2 | 3 | 0 | 38 | 262.397 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.92 | 7.03 | -133.62 | 4 | 3 | 2 | 41 | 264.413 | 3 | ↓ |