In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 21 | Yes |
Popular Name: 2-(4-isopropylpiperazin-1-yl)-1-(4-propylphenyl)ethanone 2-(4-isopropylpiperazin-1-yl)-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) | 3.36 | 9.37 | -34.28 | 1 | 3 | 1 | 25 | 289.443 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.36 | 7.14 | -6.7 | 0 | 3 | 0 | 24 | 288.435 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.36 | 9.32 | -38.77 | 1 | 3 | 1 | 25 | 289.443 | 6 | ↓ |