In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 21 | Yes |
Popular Name: N-[3-(aminomethyl)phenyl]-3-[(2S,6S)-2,6-dimethyl-1-piperidyl]propanamide N-[3-(aminomethyl)phenyl]-3-[(2S…
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) | 2.15 | 6.07 | -98.92 | 5 | 4 | 2 | 61 | 291.439 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.15 | 5.68 | -40.55 | 4 | 4 | 1 | 60 | 290.431 | 5 | ↓ |