In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2008 | 33 | Yes |
Popular Name: 4-[2-(azepan-1-yl)acetyl]-9-benzyloxy-2,3-dihydro-1H-chromeno[3,4-b]pyridin-5-one 4-[2-(azepan-1-yl)acetyl]-9-benz…
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) | 4.92 | 15.37 | -45.33 | 1 | 6 | 1 | 64 | 447.555 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.92 | 13.17 | -19.66 | 0 | 6 | 0 | 63 | 446.547 | 5 | ↓ |