In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 17 | Yes |
Popular Name: 2-(4-ethylpiperazin-1-yl)-1-(1-methylpyrrol-3-yl)ethanone 2-(4-ethylpiperazin-1-yl)-1-(1-m…
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) | 0.67 | 6.4 | -34.84 | 1 | 4 | 1 | 30 | 236.339 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.67 | 4.12 | -8.17 | 0 | 4 | 0 | 28 | 235.331 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.67 | 6.32 | -34.2 | 1 | 4 | 1 | 30 | 236.339 | 4 | ↓ |