| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2011 | 20 | Yes |
Popular Name: [(2R,3S)-4-ethyl-3-(1-methylindolin-5-yl)morpholin-2-yl]methanamine [(2R,3S)-4-ethyl-3-(1-methylindo…
| 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) | 1.01 | 3.7 | -40.66 | 3 | 4 | 1 | 43 | 276.404 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.01 | 3.33 | -3.82 | 2 | 4 | 0 | 42 | 275.396 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.01 | 4.3 | -90.34 | 4 | 4 | 2 | 45 | 277.412 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
