In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: (3S,6R)-1-[(3S)-3-amino-3-phenyl-propanoyl]-6-methyl-piperidine-3-carboxamide (3S,6R)-1-[(3S)-3-amino-3-phenyl…
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) | -1.12 | 2.92 | -51.51 | 5 | 5 | 1 | 91 | 290.387 | 4 | ↓ |
Hi High (pH 8-9.5) | -1.12 | 2.6 | -12.09 | 4 | 5 | 0 | 89 | 289.379 | 4 | ↓ |