In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2010 | 21 | Yes |
Popular Name: 2-[4-(3-hydroxyprop-1-ynyl)-2-thienyl]-3H-benzimidazole-5-carboxylic 2-[4-(3-hydroxyprop-1-ynyl)-2-th…
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) | 2.71 | 5.37 | -52.65 | 2 | 5 | -1 | 89 | 297.315 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.71 | 5.82 | -53.48 | 3 | 5 | 0 | 90 | 298.323 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.