In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 18 | Yes |
Popular Name: (2S)-N-[(4-hydroxyphenyl)methyl]-N-methyl-piperidine-2-carboxamide (2S)-N-[(4-hydroxyphenyl)methyl]…
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) | 1.26 | 3.7 | -39.06 | 3 | 4 | 1 | 57 | 249.334 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.26 | 2.48 | -10.46 | 2 | 4 | 0 | 53 | 248.326 | 3 | ↓ |