In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 25 | Yes |
Popular Name: 2-(benzotriazol-1-yl)-1-[3-(ethylamino)-7,8-dihydro-5H-pyrido[4,3-c]pyridazin-6-yl]ethanone 2-(benzotriazol-1-yl)-1-[3-(ethy…
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) | 1.36 | 5.33 | -49.66 | 2 | 8 | 1 | 90 | 338.395 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.36 | 5.22 | -23.19 | 1 | 8 | 0 | 89 | 337.387 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.36 | 5.4 | -50.54 | 2 | 8 | 1 | 90 | 338.395 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.