| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 21 | Yes |
Popular Name: (1R,2S)-1-(1-methylpyrazol-4-yl)-1-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)propan-2-amine (1R,2S)-1-(1-methylpyrazol-4-yl)…
| 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) | 1.42 | 5.59 | -41.86 | 3 | 4 | 1 | 49 | 285.415 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.42 | 5.22 | -5.01 | 2 | 4 | 0 | 47 | 284.407 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
