In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2011 | 25 | Yes |
Popular Name: 2-(2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide 2-(2-oxo-4,5-dihydro-3H-1-benzaz…
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) | 1.60 | 10.44 | -18.34 | 1 | 7 | 0 | 83 | 335.367 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.61 | 10.29 | -66.2 | 0 | 7 | -1 | 86 | 334.359 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.