In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 3rd, 2010 | 19 | Yes |
Popular Name: 1-[4-[(2S,6S)-6-methylpiperidine-2-carbonyl]-1,4-diazepan-1-yl]ethanone 1-[4-[(2S,6S)-6-methylpiperidine…
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) | 0.20 | 5.45 | -49.15 | 2 | 5 | 1 | 57 | 268.381 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.20 | 4.23 | -10.25 | 1 | 5 | 0 | 53 | 267.373 | 1 | ↓ |