In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 34 | Yes |
Popular Name: 6-[3-(azepane-1-carbonyl)phenyl]-1'-isopropyl-spiro[chromane-2,4'-piperidine]-4-one 6-[3-(azepane-1-carbonyl)phenyl]…
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) | 4.89 | 14.77 | -49.27 | 1 | 5 | 1 | 51 | 461.626 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.89 | 12.38 | -12.06 | 0 | 5 | 0 | 50 | 460.618 | 3 | ↓ |