| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 22 | Yes |
Popular Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[(4-bromo-2-thienyl)methyl-methyl-amino]ethanone 1-(4-acetyl-3,5-dimethyl-1H-pyrr…
| 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) | 3.10 | 7.22 | -13.99 | 1 | 4 | 0 | 53 | 383.311 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.10 | 9.49 | -53.1 | 2 | 4 | 1 | 54 | 384.319 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
