In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 20 | Yes |
Popular Name: 2-[(2S)-1-[2-[4-(aminomethyl)phenoxy]ethyl]-2-piperidyl]ethanol 2-[(2S)-1-[2-[4-(aminomethyl)phe…
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) | 1.74 | 4.04 | -86.78 | 5 | 4 | 2 | 62 | 280.412 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.74 | 2.49 | -46.41 | 4 | 4 | 1 | 60 | 279.404 | 7 | ↓ |