In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2009 | 20 | Yes |
Popular Name: 6-[4-(2-diethylaminoethyl)piperazin-1-yl]pyridin-3-amine 6-[4-(2-diethylaminoethyl)pipera…
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) | 1.47 | 5.49 | -72.87 | 4 | 5 | 2 | 51 | 279.432 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.47 | 3.05 | -5.01 | 2 | 5 | 0 | 49 | 277.416 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.47 | 5.17 | -37.25 | 3 | 5 | 1 | 50 | 278.424 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.47 | 7.7 | -179.35 | 5 | 5 | 3 | 52 | 280.44 | 6 | ↓ |