| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 21 | Yes |
Popular Name: 1,3-dimethyl-5-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)pyrazole-4-carboxylic 1,3-dimethyl-5-(1,3,4,5-tetrahyd…
| 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) | 2.24 | 9.84 | -36.74 | 1 | 5 | 0 | 62 | 285.347 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.24 | 9.71 | -52 | 0 | 5 | -1 | 61 | 284.339 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
