| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2010 | 24 | No |
Popular Name: (Z)-2-cyano-3-(1-isobutyl-2,5-dimethyl-pyrrol-3-yl)-N-(1-methylpyrazol-3-yl)prop-2-enamide (Z)-2-cyano-3-(1-isobutyl-2,5-di…
None
| 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) | 2.06 | 9.4 | -12.84 | 1 | 6 | 0 | 76 | 325.416 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.25 | 8.18 | -55.7 | 0 | 6 | -1 | 82 | 324.408 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
