In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2010 | 20 | Yes |
Popular Name: N-[[(2S)-1-[2-(3-bromophenoxy)ethyl]-2-piperidyl]methyl]ethanamine N-[[(2S)-1-[2-(3-bromophenoxy)et…
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) | 3.52 | 7.98 | -41.65 | 2 | 3 | 1 | 29 | 342.301 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.52 | 9.83 | -120.73 | 3 | 3 | 2 | 30 | 343.309 | 7 | ↓ |