In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 17 | Yes |
Popular Name: 2-(cyclopropylamino)-1-(4-isobutylpiperazin-1-yl)ethanone 2-(cyclopropylamino)-1-(4-isobut…
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) | 0.83 | 4.64 | -38.31 | 2 | 4 | 1 | 40 | 240.371 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.83 | 3.35 | -7.17 | 1 | 4 | 0 | 36 | 239.363 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.83 | 6.56 | -95.39 | 3 | 4 | 2 | 41 | 241.379 | 5 | ↓ |