| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2009 | 16 | No |
Popular Name: 2-[isopropyl(methyl)amino]-1-(4-nitro-1H-pyrrol-2-yl)ethanone 2-[isopropyl(methyl)amino]-1-(4-…
| 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) | 1.20 | 5.84 | -32.99 | 1 | 6 | 0 | 81 | 225.248 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.20 | 3.4 | -29.44 | 0 | 6 | -1 | 80 | 224.24 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.20 | 6.29 | -50.26 | 2 | 6 | 1 | 83 | 226.256 | 5 | ↓ |
