In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2010 | 19 | Yes |
Popular Name: (2S,6R)-N-[(1S)-1-(4-fluorophenyl)ethyl]-6-methyl-piperidine-2-carboxamide (2S,6R)-N-[(1S)-1-(4-fluoropheny…
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) | 2.55 | 6.01 | -40.21 | 3 | 3 | 1 | 46 | 265.352 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.55 | 4.84 | -6.85 | 2 | 3 | 0 | 41 | 264.344 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.