| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 16 | No |
Popular Name: (2S)-2-(5-bromo-2-furyl)-2-[(3S)-3-methylthiomorpholin-4-yl]ethanamine (2S)-2-(5-bromo-2-furyl)-2-[(3S)…
| 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) | 1.64 | 5.4 | -30.29 | 3 | 3 | 1 | 44 | 306.249 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.64 | 3.61 | -50.03 | 3 | 3 | 1 | 44 | 306.249 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.64 | 5.56 | -122.12 | 4 | 3 | 2 | 45 | 307.257 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
