In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2011 | 21 | Yes |
Popular Name: 5-chloro-6-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)pyridine-3-carboxylic 5-chloro-6-(1,3,4,5-tetrahydro-2…
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) | 3.23 | 10.24 | -43.42 | 0 | 4 | -1 | 56 | 301.753 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.23 | 10.72 | -31.42 | 1 | 4 | 0 | 58 | 302.761 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.