In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 18 | Yes |
Popular Name: N,N-dimethyl-N'-[1-(2-pyridyl)-4-piperidyl]ethane-1,2-diamine N,N-dimethyl-N'-[1-(2-pyridyl)-4…
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) | 1.35 | 5.3 | -87.55 | 3 | 4 | 2 | 37 | 250.39 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.35 | 4.97 | -42.09 | 2 | 4 | 1 | 36 | 249.382 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.35 | 7.77 | -175.26 | 4 | 4 | 3 | 38 | 251.398 | 5 | ↓ |