In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 24 | Yes |
Popular Name: 6-(1,4-diazepan-1-yl)-N-(4-methoxyphenyl)pyridine-3-carboxamide 6-(1,4-diazepan-1-yl)-N-(4-metho…
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) | 1.66 | 6.48 | -52.53 | 3 | 6 | 1 | 71 | 327.408 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.66 | 6.79 | -107.92 | 4 | 6 | 2 | 72 | 328.416 | 4 | ↓ |