In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 32 | Yes |
Popular Name: N-[6-[4-(4-bromobenzoyl)-1,4-diazepan-1-yl]-3-pyridyl]-2-fluoro-benzamide N-[6-[4-(4-bromobenzoyl)-1,4-dia…
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) | 3.85 | 11.79 | -18.14 | 1 | 6 | 0 | 66 | 497.368 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.85 | 12.08 | -49.22 | 2 | 6 | 1 | 67 | 498.376 | 4 | ↓ |