In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 32 | Yes |
Popular Name: N-[6-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-3-pyridyl]-2-phenoxy-acetamide N-[6-[4-[(4-fluorophenyl)methyl]…
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) | 3.90 | 13.46 | -51.41 | 2 | 6 | 1 | 59 | 435.523 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.90 | 13.77 | -108.95 | 3 | 6 | 2 | 60 | 436.531 | 7 | ↓ |