In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 21 | Yes |
Popular Name: (2S)-N-[2-(aminomethyl)phenyl]-2-[(3R,5S)-3,5-dimethyl-1-piperidyl]propanamide (2S)-N-[2-(aminomethyl)phenyl]-2…
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) | 2.24 | 6.61 | -109.7 | 5 | 4 | 2 | 61 | 291.439 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.24 | 4.46 | -58.92 | 4 | 4 | 1 | 60 | 290.431 | 4 | ↓ |