In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 16 | Yes |
Popular Name: 1-(4-isopropylpiperazin-1-yl)-2-(propylamino)ethanone 1-(4-isopropylpiperazin-1-yl)-2-…
None
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) | 0.54 | 3.51 | -41.03 | 2 | 4 | 1 | 40 | 228.36 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.54 | 2.16 | -6.81 | 1 | 4 | 0 | 36 | 227.352 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.54 | 5.66 | -95.7 | 3 | 4 | 2 | 41 | 229.368 | 5 | ↓ |