In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 8th, 2011 | 17 | Yes |
Popular Name: 1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)-2-methyl-2-(methylamino)propan-1-one 1-(7,8-dihydro-5H-1,6-naphthyrid…
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) | 0.86 | 3.83 | -40.07 | 2 | 4 | 1 | 50 | 234.323 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.86 | 4 | -8.61 | 1 | 4 | 0 | 45 | 233.315 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.86 | 4.22 | -83.91 | 3 | 4 | 2 | 51 | 235.331 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.