| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2011 | 24 | No |
Popular Name: (Z)-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-(4-ethylpiperazine-1-carbonyl)prop-2-enenitrile (Z)-3-(2,5-dimethyl-1-propyl-pyr…
| 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 | 8.8 | -13.08 | 0 | 5 | 0 | 52 | 328.46 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.06 | 11.02 | -45.28 | 1 | 5 | 1 | 53 | 329.468 | 5 | ↓ |
