In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 19 | Yes |
Popular Name: (2S)-N-[1-(4-bromophenyl)-1-methyl-ethyl]piperidine-2-carboxamide (2S)-N-[1-(4-bromophenyl)-1-meth…
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) | 3.31 | 6.63 | -38.21 | 3 | 3 | 1 | 46 | 326.258 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.31 | 5.3 | -6.34 | 2 | 3 | 0 | 41 | 325.25 | 3 | ↓ |