In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 7th, 2011 | 22 | Yes |
Popular Name: 1-isobutyl-N-[2-[(2R)-2-methyl-1-piperidyl]ethyl]piperidine-4-carboxamide 1-isobutyl-N-[2-[(2R)-2-methyl-1…
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) | 2.61 | 9.42 | -87.58 | 3 | 4 | 2 | 38 | 311.514 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.61 | 7.49 | -38.45 | 2 | 4 | 1 | 37 | 310.506 | 6 | ↓ |