In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 31st, 2008 | 23 | Yes |
Popular Name: N'-(1-benzyl-4-piperidyl)-N,N-diisopropyl-ethane-1,2-diamine N'-(1-benzyl-4-piperidyl)-N,N-di…
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) | 3.29 | 9.07 | -112.42 | 3 | 3 | 2 | 24 | 319.537 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.29 | 8.09 | -35.44 | 2 | 3 | 1 | 20 | 318.529 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.29 | 7.88 | -30.56 | 2 | 3 | 1 | 20 | 318.529 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.29 | 10.31 | -81.54 | 3 | 3 | 2 | 21 | 319.537 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.29 | 7.03 | -39.35 | 2 | 3 | 1 | 23 | 318.529 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.29 | 11.3 | -202.03 | 4 | 3 | 3 | 25 | 320.545 | 8 | ↓ |