In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 35 | Yes |
Popular Name: N-[6-[4-[(2,4-dimethoxyphenyl)methyl]-1,4-diazepan-1-yl]-3-pyridyl]-2-phenoxy-acetamide N-[6-[4-[(2,4-dimethoxyphenyl)me…
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) | 3.77 | 12.12 | -45.29 | 2 | 8 | 1 | 77 | 477.585 | 9 | ↓ |
Lo Low (pH 4.5-6) | 3.77 | 12.47 | -101.74 | 3 | 8 | 2 | 79 | 478.593 | 9 | ↓ |