In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 20 | Yes |
Popular Name: (2S)-N-[(1S)-1-(4-fluorophenyl)-2-methyl-propyl]piperidine-2-carboxamide (2S)-N-[(1S)-1-(4-fluorophenyl)-…
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) | 2.97 | 6.95 | -39.45 | 3 | 3 | 1 | 46 | 279.379 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.97 | 5.49 | -7.62 | 2 | 3 | 0 | 41 | 278.371 | 4 | ↓ |