| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 15 | No |
Popular Name: (2R)-2-(3-furyl)-2-[(3S)-3-methylthiomorpholin-4-yl]ethanamine (2R)-2-(3-furyl)-2-[(3S)-3-methy…
| 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 | 2.51 | -47.46 | 3 | 3 | 1 | 44 | 227.353 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.39 | 2.17 | -3.42 | 2 | 3 | 0 | 42 | 226.345 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.39 | 4.48 | -119.39 | 4 | 3 | 2 | 45 | 228.361 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
