| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 23 | No |
Popular Name: (Z)-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-(4-methylpiperazine-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) | 1.68 | 7.99 | -13.24 | 0 | 5 | 0 | 52 | 314.433 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.68 | 10.36 | -46.74 | 1 | 5 | 1 | 53 | 315.441 | 4 | ↓ |
