| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 3rd, 2011 | 24 | Yes |
Popular Name: N-[3-[(1R)-1-[(1-methylbenzimidazol-2-yl)methylamino]ethyl]phenyl]acetamide N-[3-[(1R)-1-[(1-methylbenzimida…
| 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) | 2.31 | 7 | -15.7 | 2 | 5 | 0 | 59 | 322.412 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.31 | 7.45 | -37.81 | 3 | 5 | 1 | 60 | 323.42 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.31 | 8.1 | -56.55 | 3 | 5 | 1 | 64 | 323.42 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.31 | 8.55 | -125.24 | 4 | 5 | 2 | 65 | 324.428 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
