In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 31st, 2009 | 31 | Yes |
Popular Name: N-[4-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-4-oxo-butyl]adamantane-1-carboxamide N-[4-[(2S)-2-(1-methylpyrrol-2-y…
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) | 4.80 | 12.59 | -12.72 | 1 | 5 | 0 | 54 | 425.617 | 6 | ↓ |