| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2010 | 21 | Yes |
Popular Name: (1S)-N-(quinoxalin-2-ylmethyl)-1-(2-thienyl)butan-1-amine (1S)-N-(quinoxalin-2-ylmethyl)-1…
| 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) | 4.45 | 7.87 | -42.69 | 2 | 3 | 1 | 42 | 298.435 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.45 | 6.82 | -7.86 | 1 | 3 | 0 | 38 | 297.427 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
