In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 17th, 2005 | 24 | Yes |
Popular Name: N-[2-(1-allylbenzoimidazol-2-yl)ethyl]-3-methyl-benzamide N-[2-(1-allylbenzoimidazol-2-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) | 3.67 | 9.84 | -15.98 | 1 | 4 | 0 | 47 | 319.408 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.26 | -0.1 | -36.69 | 2 | 4 | 1 | 48 | 320.416 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.74 | 8.58 | -39.9 | 2 | 4 | 1 | 52 | 320.416 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.74 | 7.52 | -28.45 | 2 | 4 | 1 | 52 | 320.416 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.67 | 10.15 | -36.78 | 2 | 4 | 1 | 48 | 320.416 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.74 | 8.9 | -97.12 | 3 | 4 | 2 | 53 | 321.424 | 6 | ↓ |