In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2009 | 20 | Yes |
Popular Name: (2S)-1-[4-(6-amino-3-pyridyl)piperazin-1-yl]-2-methyl-pentan-1-one (2S)-1-[4-(6-amino-3-pyridyl)pip…
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) | 2.19 | 5.81 | -36.73 | 3 | 5 | 1 | 64 | 277.392 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.19 | 5.35 | -10.75 | 2 | 5 | 0 | 62 | 276.384 | 4 | ↓ |