In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 15th, 2011 | 17 | Yes |
Popular Name: 1-(4-propylpiperazin-1-yl)-2-(1,2,4-triazol-1-yl)ethanone 1-(4-propylpiperazin-1-yl)-2-(1,…
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) | -0.42 | 7.5 | -56.03 | 1 | 6 | 1 | 55 | 238.315 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.42 | 5.3 | -16.87 | 0 | 6 | 0 | 54 | 237.307 | 4 | ↓ |