In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 27th, 2010 | 19 | Yes |
Popular Name: [4-(aminomethyl)phenyl]-[(3R)-3-ethoxy-1-piperidyl]methanone [4-(aminomethyl)phenyl]-[(3R)-3-…
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) | 0.84 | 4.45 | -54.81 | 3 | 4 | 1 | 57 | 263.361 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.84 | 4.04 | -7.48 | 2 | 4 | 0 | 56 | 262.353 | 4 | ↓ |