In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2010 | 17 | Yes |
Popular Name: 1-(4-isopropylpiperazin-1-yl)-2-[(2R)-pyrrolidin-2-yl]ethanone 1-(4-isopropylpiperazin-1-yl)-2-…
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) | 1.90 | 3.77 | -34.18 | 2 | 4 | 1 | 40 | 240.371 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.90 | 5.9 | -85.56 | 3 | 4 | 2 | 41 | 241.379 | 3 | ↓ |