In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: N,N-dimethyl-2-[4-[(3R)-piperidine-3-carbonyl]-1,4-diazepan-1-yl]acetamide N,N-dimethyl-2-[4-[(3R)-piperidi…
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) | -1.06 | 5.67 | -96.44 | 3 | 6 | 2 | 62 | 298.431 | 3 | ↓ |
Hi High (pH 8-9.5) | -1.06 | 3.91 | -51.03 | 2 | 6 | 1 | 60 | 297.423 | 3 | ↓ |