| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2011 | 22 | Yes |
Popular Name: 2-[butyl(methyl)amino]-1-(1-cyclohexyl-2,5-dimethyl-pyrrol-3-yl)ethanone 2-[butyl(methyl)amino]-1-(1-cycl…
| 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) | 4.19 | 12.39 | -33.75 | 1 | 3 | 1 | 26 | 305.486 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.19 | 10.14 | -6.16 | 0 | 3 | 0 | 25 | 304.478 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
