In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2011 | 21 | Yes |
Popular Name: 2-[5-[(2-ethylbenzimidazol-1-yl)methyl]-1,2,4-oxadiazol-3-yl]propan-2-amine 2-[5-[(2-ethylbenzimidazol-1-yl)…
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) | 2.04 | 3.94 | -51.63 | 3 | 6 | 1 | 84 | 286.359 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.04 | 3.69 | -11.13 | 2 | 6 | 0 | 83 | 285.351 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.04 | 4.26 | -86.39 | 4 | 6 | 2 | 86 | 287.367 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.