In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 32 | Yes |
Popular Name: 4-fluoro-N-[6-[4-[(3-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-3-pyridyl]benzamide 4-fluoro-N-[6-[4-[(3-methoxyphen…
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) | 3.96 | 12.26 | -45.34 | 2 | 6 | 1 | 59 | 435.523 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.96 | 12.62 | -102.89 | 3 | 6 | 2 | 60 | 436.531 | 6 | ↓ |