In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2010 | 21 | Yes |
Popular Name: (3S)-1-[2-oxo-2-(pentylamino)ethyl]-N-propyl-piperidine-3-carboxamide (3S)-1-[2-oxo-2-(pentylamino)eth…
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) | 2.65 | 5.94 | -38.78 | 3 | 5 | 1 | 63 | 298.451 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.65 | 3.78 | -10.43 | 2 | 5 | 0 | 61 | 297.443 | 9 | ↓ |