| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2010 | 23 | Yes |
Popular Name: 2-methyl-4-[5-[[propyl(3-pyridylmethyl)amino]methyl]-2-thienyl]but-3-yn-2-ol 2-methyl-4-[5-[[propyl(3-pyridyl…
| 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) | 3.30 | 7.03 | -7.72 | 1 | 3 | 0 | 36 | 328.481 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.30 | 9.2 | -44.47 | 2 | 3 | 1 | 38 | 329.489 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
