| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 21 | Yes |
Popular Name: (1R)-1-(1-isopropylbenzimidazol-2-yl)-1-phenyl-ethanamine (1R)-1-(1-isopropylbenzimidazol-…
| 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) | 3.75 | 7.69 | -7.17 | 2 | 3 | 0 | 44 | 279.387 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.75 | 8.09 | -22.8 | 3 | 3 | 1 | 45 | 280.395 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.75 | 7.89 | -45.77 | 3 | 3 | 1 | 45 | 280.395 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.75 | 8.29 | -101.38 | 4 | 3 | 2 | 47 | 281.403 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
