In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2011 | 24 | Yes |
Popular Name: 3-[7-(5-chloro-2-pyridyl)-9-hydroxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]propanamide 3-[7-(5-chloro-2-pyridyl)-9-hydr…
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) | 1.57 | 3.2 | -45 | 4 | 6 | 1 | 90 | 348.81 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.57 | 1.12 | -12.77 | 3 | 6 | 0 | 89 | 347.802 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.