In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 20 | Yes |
Popular Name: (1R)-1-[(3S)-1-ethyl-3-piperidyl]-N-[2-(3-fluorophenyl)ethyl]ethanamine (1R)-1-[(3S)-1-ethyl-3-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) | 3.55 | 10.16 | -106.24 | 3 | 2 | 2 | 21 | 280.431 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.55 | 9.07 | -33.86 | 2 | 2 | 1 | 16 | 279.423 | 6 | ↓ |