In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 21 | Yes |
Popular Name: N'-benzyl-N-(1-ethyl-4-piperidyl)-N'-methyl-propane-1,3-diamine N'-benzyl-N-(1-ethyl-4-piperidyl…
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) | 2.59 | 6.22 | -39.75 | 2 | 3 | 1 | 23 | 290.475 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.59 | 8.46 | -103.8 | 3 | 3 | 2 | 24 | 291.483 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.59 | 10.8 | -188.32 | 4 | 3 | 3 | 25 | 292.491 | 8 | ↓ |