In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2009 | 19 | Yes |
Popular Name: 1-[4-(3-amino-2-pyridyl)piperazin-1-yl]-3-methyl-butan-1-one 1-[4-(3-amino-2-pyridyl)piperazi…
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) | 1.44 | 5.9 | -35.38 | 3 | 5 | 1 | 64 | 263.365 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.44 | 5.44 | -9.17 | 2 | 5 | 0 | 62 | 262.357 | 3 | ↓ |