In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 16 | Yes |
Popular Name: 2-[(2S)-2-methyl-1-piperidyl]-1-(1-methylpyrrol-2-yl)ethanone 2-[(2S)-2-methyl-1-piperidyl]-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) | 1.95 | 8.36 | -32.45 | 1 | 3 | 1 | 26 | 221.324 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.95 | 6.32 | -6.67 | 0 | 3 | 0 | 25 | 220.316 | 3 | ↓ |