| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2011 | 17 | Yes |
Popular Name: [(2S,3S)-4-isopropyl-3-(1-methylpyrazol-4-yl)morpholin-2-yl]methanamine [(2S,3S)-4-isopropyl-3-(1-methyl…
| 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) | -0.39 | 0.5 | -42.3 | 3 | 5 | 1 | 58 | 239.343 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.39 | 0.13 | -5.72 | 2 | 5 | 0 | 56 | 238.335 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -0.39 | 2.57 | -99.25 | 4 | 5 | 2 | 59 | 240.351 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
