In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 21 | Yes |
Popular Name: 4-[4-[(2S)-2-ethylhexyl]piperazin-1-yl]pyridin-3-amine 4-[4-[(2S)-2-ethylhexyl]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) | 3.46 | 9.07 | -86.04 | 4 | 4 | 2 | 48 | 292.471 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.46 | 7.28 | -29.38 | 3 | 4 | 1 | 47 | 291.463 | 7 | ↓ |