In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 20 | Yes |
Popular Name: (1R)-2-[(3S)-3-ethyl-1-piperidyl]-1-(2,4,6-trimethylphenyl)ethanamine (1R)-2-[(3S)-3-ethyl-1-piperidyl…
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) | 2.31 | 9.43 | -33.39 | 3 | 2 | 1 | 30 | 275.46 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.31 | 9.77 | -127.43 | 4 | 2 | 2 | 32 | 276.468 | 4 | ↓ |