In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 21 | Yes |
Popular Name: (2S)-4-[(1-acetyl-4-piperidyl)amino]-2-isopropyl-2-methyl-4-oxo-butanoic (2S)-4-[(1-acetyl-4-piperidyl)am…
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) | 0.45 | 6.15 | -63.15 | 1 | 6 | -1 | 90 | 297.375 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.45 | 3.63 | -11.53 | 2 | 6 | 0 | 87 | 298.383 | 5 | ↓ |