In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2010 | 20 | No |
Popular Name: (8-isopropyl-3,4-dihydro-2H-[1,4]dioxepino[2,3-g]quinolin-10-yl)hydrazine (8-isopropyl-3,4-dihydro-2H-[1,4…
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) | 2.67 | 4.75 | -26.74 | 4 | 5 | 1 | 71 | 274.344 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.84 | 4.91 | -27.73 | 4 | 5 | 1 | 74 | 274.344 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.