In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2008 | 29 | No |
Popular Name: 2-[2-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-yl]ethyl]isoindoline-1,3-dione 2-[2-[4-(2-isopropyl-6-methyl-py…
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) | 2.93 | 7.78 | -34.76 | 1 | 7 | 1 | 73 | 394.499 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.93 | 7.41 | -12.24 | 0 | 7 | 0 | 71 | 393.491 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.93 | 10.16 | -87.56 | 2 | 7 | 2 | 74 | 395.507 | 5 | ↓ |