| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2011 | 17 | Yes |
Popular Name: (2S)-1-[1-[(5-ethyl-2-thienyl)methyl]imidazol-2-yl]propan-2-amine (2S)-1-[1-[(5-ethyl-2-thienyl)me…
| 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) | 1.77 | 6.88 | -38.83 | 3 | 3 | 1 | 45 | 250.391 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.77 | 6.52 | -7.26 | 2 | 3 | 0 | 44 | 249.383 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.77 | 7.45 | -104.68 | 4 | 3 | 2 | 47 | 251.399 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
