In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2011 | 21 | Yes |
Popular Name: 5-chloro-6-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)pyridine-3-carboxylic 5-chloro-6-(3,5-dihydro-2H-1,4-b…
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) | 2.59 | 8.45 | -45.17 | 0 | 5 | -1 | 65 | 303.725 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.59 | 8.93 | -31.62 | 1 | 5 | 0 | 67 | 304.733 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.